American Mineralogist Crystal Structure Database

191 matching records for this search.

Melonite
Download hom/melonite.pdf
Peacock M A, Thompson R M
 
American Mineralogist 31 (1946) 204-204
On melonite from Quebec and the crystal structure of NiTe2
_database_code_amcsd 0000033
3.835 3.835 5.255 90 90 120 P-3m1
atom   x   y   z
Ni     0   0   0
Te   1/3 2/3 .25
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #1 based on HCP stacking sequence ABAB. Has the bonding topology of
observed HT-C2/c pyroxenes.
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0002996
7.3936910 6 3.4641016 90 117.9383 90 C2/c
atom  x     y     z
Mg1   0 11/12   1/4
Mg2   0   .25   1/4
Si 5/16  1/12 19/48
O1  1/8  1/12  5/24
O2  3/8   .25  7/24
O3  3/8 11/12  7/24
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #2 based on stacking sequence ABAC. Ideal analogue of  protopyroxene,
high-P protopyroxene.
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0002997
6.5319726 6 3.4641016 90 90 90 *P2_1cn
0 .25 0
atom    x     y   z
Mg1     0  1/12 2/3
Mg2     0   .25 1/6
SiA 11/16 11/12 5/6
SiB  5/16  1/12   0
O1A   7/8 11/12 5/6
O1B   1/8  1/12   0
O2A   5/8   3/4   0
O2B   3/8   .25 1/6
O3A   5/8 11/12 1/2
O3B   3/8 11/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #3a based on stacking sequence ABABCACABCBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0002998
6.6332495 6 3.4641016 90 100.0250 90 P2/c
atom    x     y     z
SiA 11/16  7/12  5/16
SiB 13/16 11/12  1/48
Mg1a    0  7/12   3/4
Mg2a    0   .25   3/4
Mg1b  1/2  1/12   3/4
Mg2b  1/2   3/4   3/4
O1A   7/8  7/12   3/8
O2A   5/8   3/4 11/24
O3A   5/8  5/12 11/24
O1B   5/8  1/12 11/24
O2B   7/8   .25   3/8
O3B   7/8 11/12   3/8
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #3b based on stacking sequence ABABCACABCBC. Ideal analogue of low
clinopyroxene.
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0002999
6.9282032 6 3.4641016 90 109.4712 90 P2_1/c
atom   x   y    z
SiA 1/16 1/3  3/8
SiB 9/16 5/6 5/24
Mg1  .25 2/3  1/6
Mg2  .25   0  1/6
O1A  7/8 1/3  1/4
O1B  3/8 5/6 1/12
O2A  1/8 1/2  1/4
O2B  5/8   0 5/12
O3A  1/8 1/3  3/4
O3B  5/8 2/3 5/12
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #4 based on CCP stacking sequence ABCABCABCABC. Ideal analogue of HP-C2/c
pyroxene and eight-coordinaSiEd Mg2-C2/c pyroxene.
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003000
6.6332495 6.0 3.4641016 90 100.0250 90 C2/c
atom  x     y    z
Si 5/16  1/12 3/16
Mg1   0 11/12  1/4
Mg2   0   .25  1/4
O1  1/8  1/12  1/8
O2  3/8   .25  3/8
O3  3/8  1/12  7/8
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #5 based on stacking sequence ABABABAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003001
13.063945 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA  31/32 11/12 1/6
SiB  29/32  5/12   0
Mg1a 13/16  1/12 1/3
Mg2a 13/16   3/4 1/3
SiC  23/32  7/12 5/6
SiD  21/32 11/12 1/2
Mg1b  9/16  7/12 1/6
Mg2b  9/16   .25 1/6
SiE  13/32  7/12 1/2
SiF  15/32  1/12 1/3
Mg1c  5/16  1/12 2/3
Mg2c  5/16   3/4 2/3
SiG   5/32  1/12   0
SiH   7/32  5/12 1/3
Mg1d  1/16  5/12 2/3
Mg2d  1/16   .25 1/6
O1A    7/8 11/12 1/6
O2A      0   3/4   0
O3A      0  1/12   0
O1B      0  5/12   0
O2B    7/8  7/12 1/6
O3B    7/8   3/4 2/3
O1C    5/8  5/12 1/3
O2C    3/4   3/4   0
O3C    3/4  5/12   0
O1D    3/4  1/12   0
O2D    5/8   3/4 1/3
O3D    5/8 1 /12 1/3
O1E    1/2  5/12   0
O2E    3/8   3/4 1/3
O3E    3/8  5/12 1/3
O1F    3/8  1/12 1/3
O2F    1/2   3/4   0
O3F    1/2  1/12   0
O1G    .25  1/12   0
O2G    1/8   3/4 1/3
O3G    1/8  1/12 1/3
O1H    1/8  5/12 1/3
O2H    .25   .25 1/2
O3H    .25  5/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #6 based on stacking sequence ABABACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003002
13.063945 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA  31/32 11/12 1/6
SiB  29/32  5/12   0
Mg1a 13/16  1/12   0
Mg2a 13/16   3/4   0
SiC  23/32  5/12 2/3
SiD  21/32  1/12 1/3
Mg1b  9/16  5/12 1/3
Mg2b  9/16   3/4 1/3
SiE  13/32  7/12 1/2
SiF  15/32  1/12 1/3
Mg1c  5/16  1/12 2/3
Mg2c  5/16   3/4 2/3
SiG   5/32  1/12   0
SiH   7/32  5/12 1/3
Mg1d  1/16  5/12 2/3
Mg2d  1/16   .25 1/6
O1A    7/8 11/12 1/6
O2A      0   3/4   0
O3A      0  1/12   0
O1B      0  5/12   0
O2B    7/8  7/12 1/6
O3B    7/8   3/4 2/3
O1C    5/8  5/12 2/3
O2C    3/4   .25 5/6
O3C    3/4  5/12 1/3
O1D    3/4  1/12 1/3
O2D    5/8   .25 1/6
O3D    5/8 11/12 1/6
O1E    1/2  5/12   0
O2E    3/8   3/4 1/3
O3E    3/8  5/12 1/3
O1F    3/8  1/12 1/3
O2F    1/2   3/4   0
O3F    1/2  1/12   0
O1G    .25  1/12   0
O2G    1/8   3/4 1/3
O3G    1/8  1/12 1/3
O1H    1/8  5/12 1/3
O2H    .25   .25 1/2
O3H    .25  5/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #7 based on stacking sequence ABABACAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003003
13.063945 6 3.4641016 90 90 90 P2_1ca
atom    x     y     z
SiA 31/32 11/12 11/12
SiB 29/32  5/12   3/4
Mg1a 5/16  1/12  5/12
Mg2a 5/16   3/4  5/12
SiC  5/32  1/12   3/4
SiD  7/32  5/12  1/12
Mg1b 1/16  5/12  5/12
Mg2b 1/16   .25 11/12
O1A   7/8 11/12 11/12
O2A     0   3/4   3/4
O3A     0  1/12   3/4
O1B     0  5/12   3/4
O2B   7/8  7/12 11/12
O3B   7/8   3/4  5/12
O1C   .25  1/12   3/4
O2C   1/8   3/4  1/12
O3C   1/8  1/12  1/12
O1D   1/8  5/12  1/12
O2D   .25   .25   1/4
O3D   .25  5/12   3/4
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #8a based on stacking sequence ABABCABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003004
13.063945 6 3.4641016 90 90. 90 P2/c
atom    x     y     z
SiA 29/32 11/12  1/12
SiB 27/32  5/12 11/12
SiC 13/32 11/12   3/4
SiD 11/32  7/12  1/12
Mg1a    0  5/12   1/4
Mg2a    0   .25   3/4
Mg1b  .25 11/12  1/12
Mg2b  .25   .25  1/12
Mg1c  1/2  7/12   3/4
Mg2c  1/2   .25   3/4
O1A 13/16 11/12  1/12
O2A 15/16   3/4 11/12
O3A 15/16  1/12 11/12
O1B 15/16  5/12 11/12
O2B 13/16   .25  1/12
O3B 13/16  7/12  1/12
O1C  5/16 11/12   3/4
O2C  7/16   3/4  7/12
O3C  7/16 11/12  1/12
O1D  7/16  7/12  1/12
O2D  5/16   3/4   1/4
O3D  5/16  7/12   3/4
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #8b based on stacking sequence ABABCABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003005
13.063945 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
SiA 31/32 1/6 1/3
Mg1a  7/8 2/3 1/2
Mg2a  7/8   0 1/2
SiB  9/32 1/3 1/6
SiC  7/32 2/3 1/2
SiD 15/32 1/3 1/6
Mg1b  3/8 2/3 1/6
Mg2b  3/8   0 1/6
O1A  1/16 1/6 1/3
O2A 15/16   0 1/6
O3A 15/16 1/3 1/6
O1B  3/16 1/3 1/6
O2B  5/16 1/2   0
O3B  5/16 1/3 1/2
O1C  5/16 2/3 1/2
O2C  3/16 1/2 2/3
O3C  3/16 2/3 1/6
O1D  9/16 1/3 1/6
O2D  7/16 1/2 1/3
O3D  7/16 1/6 1/3
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #9a based on stacking sequence ABABCBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003006
13.063948 6 3.4641016 90 90. 90 P2/c
atom    x     y     z
SiA 29/32 11/12  1/12
SiB 27/32  5/12 11/12
SiC 13/32 11/12   3/4
SiD 11/32  7/12  5/12
Mg1a    0  5/12   1/4
Mg2a    0   .25   3/4
Mg1b  .25 11/12  1/12
Mg2b  .25   .25  1/12
Mg1c  1/2  7/12   3/4
Mg2c  1/2   .25   3/4
O1A 13/16 11/12  1/12
O2A 15/16   3/4 11/12
O3A 15/16  1/12 11/12
O1B 15/16  5/12 11/12
O2B 13/16   .25  1/12
O3B 13/16  7/12  1/12
O1C  5/16 11/12   3/4
O2C  7/16   3/4 11/12
O3C  7/16  1/12 11/12
O1D  7/16  7/12  5/12
O2D  5/16   3/4   1/4
O3D  5/16  7/12   3/4
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #9b based on stacking sequence ABABCBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003007
13.063945 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
SiA 31/32 1/6 1/3
Mg1a  7/8 2/3 1/2
Mg2a  7/8   0 1/2
SiB  9/32 1/3 1/6
SiC  7/32 2/3 1/2
SiD 15/32 1/6 1/3
Mg1b  3/8 2/3 5/6
Mg2b  3/8   0 5/6
O1A  1/16 1/6 1/3
O2A 15/16   0 1/6
O3A 15/16 1/3 1/6
O1B  3/16 1/3 1/6
O2B  5/16 1/2   0
O3B  5/16 1/3 1/2
O1C  5/16 2/3 1/2
O2C  3/16 1/2 2/3
O3C  3/16 2/3 1/6
O1D  9/16 1/6 1/3
O2D  7/16   0 1/6
O3D  7/16 1/3 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #10 based on stacking sequence ABACBABC. Ideal analogue to orthopyroxene.
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003008
13.063945 6 3.4641016 90 90 90 *P2_1ca
0 .25 0
atom    x   y    z
SiA  9/32 1/6 7/12
SiB  7/32 2/3 5/12
Mg1a  1/8 1/3 5/12
Mg2a  1/8   0 5/12
SiC 15/32 1/6  1/4
SiD 17/32 5/6 7/12
Mg1b  7/8 2/3  3/4
Mg2b  7/8 1/2  1/4
O1A  3/16 1/6 7/12
O2A  5/16   0 5/12
O3A  5/16 1/3 5/12
O1B  5/16 2/3 5/12
O2B  3/16 1/2 7/12
O3B  3/16 5/6 7/12
O1C  9/16 1/6  1/4
O2C  7/16   0 1/12
O3C  7/16 1/6 7/12
O1D  7/16 5/6 7/12
O2D  9/16   0  3/4
O3D  9/16 5/6  1/4
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #11a based on stacking sequence ABABABABCABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003009
19.595917 6 3.4641016 90 90. 90 P2/c
atom    x    y     z
SiA  1/16 7/12  5/12
SiB  5/48 1/12  7/12
SiC 11/48 1/12 11/12
SiD 13/48 5/12  7/12
SiE 19/48 5/12  7/12
SiF  7/16 1/12   1/4
Mg1a    0 1/12   1/4
Mg2a    0  .25   3/4
Mg1b  1/6 5/12   1/4
Mg2b  1/6  .25   3/4
Mg1c  1/3 1/12  7/12
Mg2c  1/3  .25  1/12
Mg1d  1/2 5/12   1/4
Mg2d  1/2  .25   3/4
O1A   1/8 7/12  5/12
O2A  1/24  3/4  7/12
O3A  1/24 5/12  7/12
O1B  1/24 1/12  7/12
O2B   1/8  .25  5/12
O3B   1/8 1/12 11/12
O1C  7/24 1/12 11/12
O2C  5/24  .25  1/12
O3C  5/24 1/12  7/12
O1D  5/24 5/12  7/12
O2D  7/24  .25  5/12
O3D  7/24 7/12  5/12
O1E 11/24 5/12  7/12
O2E   3/8  .25   3/4
O3E   3/8 7/12   3/4
O1F   3/8 1/12   1/4
O2F 11/24  .25  1/12
O3F 11/24 1/12  7/12
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #11b based on stacking sequence ABABABABCABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003010
19.595917 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
Mg1a 1/12 2/3 1/2
Mg2a 1/12 1/2   0
Mg1b  .25 1/3 1/2
Mg2b  .25 1/2   0
Mg1c 5/12 5/6 2/3
Mg2c 5/12 1/2 2/3
SiA  7/48 1/6 1/3
SiB  3/16 5/6 2/3
SiC  5/16 2/3 1/2
SiD 17/48 1/3 1/6
SiE 23/48 1/6 2/3
SiF  1/48 1/6 2/3
O1A  5/24 1/6 1/3
O2A   1/8   0 1/6
O3A   1/8 1/6 2/3
O1B   1/8 5/6 2/3
O2B  5/24   0 5/6
O3B  5/24 5/6 1/3
O1C   3/8 2/3 1/2
O2C  7/24 1/2 2/3
O3C  7/24 5/6 2/3
O1D  7/24 1/3 1/6
O2D   3/8 1/2   0
O3D   3/8 1/6   0
O1E 13/24 1/6 2/3
O2E 11/24   0 5/6
O3E 11/24 1/6 1/3
O1F 23/24 1/6 2/3
O2F  1/24   0 5/6
O3F  1/24 1/6 1/3
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #12a based on stacking sequence ABABABABCBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003011
19.595917 6 3.4641016 90 90. 90 P2/c
atom    x     y     z
SiA  1/16  7/12  5/12
SiB  5/48  1/12  7/12
SiC 11/48  1/12 11/12
SiD 13/48  5/12  7/12
SiE 19/48  7/12  5/12
SiF  7/16  1/12   1/4
Mg1a    0  1/12   1/4
Mg2a    0   .25   3/4
Mg1b  1/6  5/12   1/4
Mg2b  1/6   .25   3/4
Mg1c  1/3  1/12  7/12
Mg2c  1/3   .25  1/12
Mg1d  1/2  5/12   1/4
Mg2d  1/2   .25   3/4
O1A   1/8  7/12  5/12
O2A  1/24   3/4  7/12
O3A  1/24  5/12  7/12
O1B  1/24  1/12  7/12
O2B   1/8   .25  5/12
O3B   1/8  1/12 11/12
O1C  7/24  1/12 11/12
O2C  5/24   .25  1/12
O3C  5/24  1/12  7/12
O1D  5/24  5/12  7/12
O2D  7/24   .25  5/12
O3D  7/24  7/12  5/12
O1E 11/24  7/12  5/12
O2E   3/8   .25   3/4
O3E   3/8  7/12   3/4
O1F   3/8  1/12   1/4
O2F 11/24   .25  5/12
O3F 11/24 11/12  5/12
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #12b based on stacking sequence ABABABABCBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003012
19.595917 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
Mg1a 1/12 2/3 1/2
Mg2a 1/12 1/2   0
Mg1b  .25 1/3 1/2
Mg2b  .25 1/2   0
Mg1c 5/12 2/3 5/6
Mg2c 5/12 1/2 1/3
SiA  7/48 1/6 1/3
SiB  3/16 5/6 2/3
SiC  5/16 2/3 1/2
SiD 17/48 1/3 1/6
SiE 23/48 1/6 1/3
SiF  1/48 1/6 2/3
O1A  5/24 1/6 1/3
O2A   1/8   0 1/6
O3A   1/8 1/6 2/3
O1B   1/8 5/6 2/3
O2B  5/24   0 5/6
O3B  5/24 5/6 1/3
O1C   3/8 2/3 1/2
O2C  7/24 1/2 2/3
O3C  7/24 5/6 2/3
O1D  7/24 1/3 1/6
O2D   3/8 1/2   0
O3D   3/8 1/6   0
O1E 13/24 1/6 1/3
O2E 11/24   0 1/6
O3E 11/24 1/6 2/3
O1F 23/24 1/6 2/3
O2F  1/24   0 5/6
O3F  1/24 1/6 1/3
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #13 based on stacking sequence ABABABACACAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003013
19.595917 6 3.4641016 90 90 90 P2_1cn
atom     x   y   z
SiA   1/48 2/3 1/3
SiB   1/16 1/3   0
SiC   3/16 1/6 5/6
SiD  11/48 2/3   0
SiE  17/48 2/3 1/3
SiF  19/48 1/3   0
Mg1a   1/8 2/3 2/3
Mg2a   1/8   0 2/3
Mg1b  7/24 1/3 2/3
Mg2b  7/24   0 2/3
Mg1c 11/24 2/3 2/3
Mg2c 11/24   0 2/3
O1A   1/12 2/3 1/3
O2A      0 1/2 1/2
O3A      0 5/6 1/2
O1B      0 1/3   0
O2B   1/12   0 1/3
O3B   1/12 1/3 1/3
O1C    .25 1/6 5/6
O2C    1/6   0   0
O3C    1/6 1/3   0
O1D    1/6 2/3   0
O2D    .25   0 1/3
O3D    .25 2/3 1/3
O1E   5/12 2/3 1/3
O2E    1/3   0   0
O3E    1/3 2/3   0
O1F    1/3 1/3   0
O2F   5/12   0 1/3
O3F   5/12 1/3 1/3
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #14a based on stacking sequence ABABABCABABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003014
19.595917 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
SiA  7/48 5/6 2/3
SiB  3/16 1/6 1/3
SiC  5/16 1/6 1/3
SiD 17/48 5/6   0
SiE 25/48 1/3 1/6
SiF  1/48 5/6 1/3
Mg1a 1/12 1/6   0
Mg2a 1/12   0 1/2
Mg1b  .25 2/3 5/6
Mg2b  .25 1/2 1/3
Mg1c 5/12 1/6   0
Mg2c 5/12   0 1/2
O1A  5/24 5/6 2/3
O2A   1/8   0 5/6
O3A   1/8 5/6 1/3
O1B   1/8 1/6 1/3
O2B  5/24   0 1/6
O3B  5/24 1/6 2/3
O1C   3/8 1/6 1/3
O2C  7/24   0 1/2
O3C  7/24 1/6   0
O1D  7/24 5/6   0
O2D   3/8   0 5/6
O3D   3/8 5/6 1/3
O1E 11/24 1/3 1/6
O2E 13/24   0 5/6
O3E 13/24 1/6 1/3
O1F 23/24 5/6 1/3
O2F  1/24   0 1/6
O3F  1/24 5/6 2/3
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #14b based on stacking sequence ABABABCABABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003015
19.595917 6 3.4641016 90 90. 90 P2/c
atom    x    y     z
SiA  1/16 7/12  1/12
SiB  5/48 1/12 11/12
SiC 11/48 1/12   1/4
SiD 13/48 7/12  5/12
SiE 19/48 7/12  5/12
SiF  7/16 1/12  7/12
Mg1a    0 1/12   1/4
Mg2a    0  .25   3/4
Mg1b  1/6 5/12   1/4
Mg2b  1/6  .25   3/4
Mg1c  1/3 1/12 11/12
Mg2c  1/3  .25  5/12
Mg1d  1/2 5/12   1/4
Mg2d  1/2  .25   3/4
O1A   1/8 7/12  1/12
O2A  1/24  .25  5/12
O3A  1/24 7/12  5/12
O1B  1/24 1/12 11/12
O2B   1/8  .25  1/12
O3B   1/8 1/12  7/12
O1C  7/24 1/12   1/4
O2C  5/24  .25  5/12
O3C  5/24 1/12 11/12
O1D  5/24 7/12  5/12
O2D  7/24  3/4   1/4
O3D  7/24 5/12   1/4
O1E 11/24 7/12  5/12
O2E   3/8  .25  1/12
O3E   3/8 7/12  1/12
O1F   3/8 1/12  7/12
O2F 11/24  .25  5/12
O3F 11/24 1/12 11/12
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #15a based on stacking sequence ABABABCBABAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003016
19.595917 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
SiA  1/48 5/6 1/3
Mg1a 1/12 1/6   0
Mg2a 1/12   0 1/2
SiB  7/48 2/3 1/6
SiC  3/16 1/6 1/3
Mg1b  .25 2/3 5/6
Mg2b  .25   0 5/6
SiD  5/16 1/3 1/6
SiE 17/48 5/6   0
Mg1c 5/12 1/6   0
Mg2c 5/12   0 1/2
SiF 23/48 2/3 1/6
O1A 23/24 5/6 1/3
O2A  1/24   0 1/6
O3A  1/24 5/6 2/3
O1B  5/24 2/3 1/6
O2B   1/8   0 5/6
O3B   1/8 5/6 1/3
O1C   1/8 1/6 1/3
O2C  5/24   0 1/6
O3C  5/24 1/3 1/6
O1D   3/8 1/3 1/6
O2D  7/24   0 1/2
O3D  7/24 1/6   0
O1E  7/24 5/6   0
O2E   3/8   0 1/6
O3E   3/8 2/3 1/6
O1F 13/24 2/3 1/6
O2F 11/24   0 5/6
O3F 11/24 5/6 1/3
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #15b based on stacking sequence ABABABCBABAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003017
19.595917 6 3.4641016 90 90. 90 P2/c
atom    x    y     z
SiA  1/16 7/12  1/12
SiB  5/48 1/12 11/12
Mg1a  1/6 5/12   1/4
Mg2a  1/6  .25   3/4
SiC 11/48 1/12   1/4
SiD 13/48 7/12  5/12
Mg1b  1/3 1/12  7/12
Mg2b  1/3  .25  1/12
SiE 19/48 7/12  1/12
SiF  7/16 1/12 11/12
Mg1c  1/2 5/12   1/4
Mg2c  1/2  .25   3/4
Mg1d    0 1/12   1/4
Mg2d    0  .25   3/4
O1A   1/8 7/12  1/12
O2A  1/24  .25  5/12
O3A  1/24 7/12  5/12
O1B  1/24 1/12 11/12
O2B   1/8  .25  1/12
O3B   1/8 1/12  7/12
O1C  7/24 1/12   1/4
O2C  5/24  .25  5/12
O3C  5/24 1/12 11/12
O1D  5/24 7/12  5/12
O2D  7/24  .25   3/4
O3D  7/24 5/12   1/4
O1E 11/24 7/12  1/12
O2E   3/8  .25  5/12
O3E   3/8 7/12  5/12
O1F   3/8 1/12 11/12
O2F 11/24  .25  1/12
O3F 11/24 1/12  7/12
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #16 based on stacking sequence ABABACABABAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003018
19.899748 6 3.4641016 90 100.024987862 90 Cc
atom     x    y     z
SiA   1/48 5/12 17/48
SiB   1/16 1/12  1/16
Mg1a   1/8 5/12 19/24
Mg2a   1/8  .25  7/24
SiC   3/16 1/12 25/48
SiD  11/48 5/12 11/48
Mg1b  7/24 1/12 23/24
Mg2b  7/24  .25 11/24
SiE  17/48 7/12 25/48
SiF  19/48 1/12 19/48
Mg1c 11/24 5/12 19/24
Mg2c 11/24  .25  7/24
O1A   1/12 5/12  5/12
O2A      0  3/4     0
O3A      0 5/12     0
O1B      0 1/12     0
O2B   1/12  .25 11/12
O3B   1/12 1/12  5/12
O1C    .25 1/12  7/12
O2C    1/6  .25   2/3
O3C    1/6 1/12   1/6
O1D    1/6 5/12   1/6
O2D    .25  3/4  7/12
O3D    .25 5/12  7/12
O1E   5/12 7/12  7/12
O2E    1/3  3/4   1/3
O3E    1/3 5/12   1/3
O1F    1/3 1/12   1/3
O2F   5/12  .25  7/12
O3F   5/12 1/12  1/12
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #17a based on stacking sequence ABABACACBCBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003019
19.595917 6 3.4641016 90 90. 90 P2/c
atom    x    y     z
Mg1a    0 5/12   1/4
Mg2a    0  .25   3/4
SiA  1/16 1/12  7/12
SiB  5/48 7/12  5/12
Mg1b  1/6 1/12 11/12
Mg2b  1/6  .25  5/12
SiC 11/48 7/12  1/12
SiD 13/48 1/12   1/4
Mg1c  1/3 5/12 11/12
Mg2c  1/3  .25  5/12
SiE 19/48 1/12  7/12
SiF  7/16 5/12   1/4
Mg1d  1/2 1/12   1/4
Mg2d  1/2  .25   3/4
O1A   1/8 1/12  7/12
O2A  1/24  .25  5/12
O3A  1/24 1/12 11/12
O1B  1/24 7/12  5/12
O2B   1/8  .25  1/12
O3B   1/8 7/12  1/12
O1C  7/24 7/12  1/12
O2C  5/24  3/4   1/4
O3C  5/24 5/12   1/4
O1D  5/24 1/12   1/4
O2D  7/24  .25  1/12
O3D  7/24 1/12  7/12
O1E 11/24 1/12  7/12
O2E   3/8  .25   3/4
O3E   3/8 1/12   1/4
O1F   3/8 5/12   1/4
O2F 11/24  .25  1/12
O3F 11/24 7/12  1/12
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #17b based on stacking sequence ABABACACBCBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003020
19.595917 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
SiA  1/48 2/3 1/3
Mg1a 1/12 1/6 1/2
Mg2a 1/12   0   0
SiB  7/48 2/3   0
SiC  3/16 1/3 1/3
Mg1b  .25 2/3 2/3
Mg2b  .25   0 2/3
SiD  5/16 1/3   0
SiE 17/48 2/3 1/3
Mg1c 5/12 1/6 1/6
Mg2c 5/12   0 2/3
SiF 23/48 5/6 1/6
O1A 23/24 2/3 1/3
O2A  1/24   0 2/3
O3A  1/24 2/3 2/3
O1B  5/24 2/3   0
O2B   1/8   0 1/3
O3B   1/8 2/3 1/3
O1C   1/8 1/3 1/3
O2C  5/24   0   0
O3C  5/24 1/3   0
O1D   3/8 1/3   0
O2D  7/24   0 1/3
O3D  7/24 1/3 1/3
O1E  7/24 2/3 1/3
O2E   3/8   0   0
O3E   3/8 2/3   0
O1F 13/24 5/6 1/6
O2F 11/24   0 1/3
O3F 11/24 2/3 1/3
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #18 based on stacking sequence ABABACBABABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003021
19.595917 6 3.4641016 90 90 90 P2_1cn
atom     x   y   z
SiA   1/16 1/6 1/3
SiB   1/48 2/3 1/6
Mg1a   1/8 2/3 1/2
Mg2a   1/8   0 1/2
SiC   3/16 1/3 1/6
SiD  11/48 5/6 1/3
Mg1b  7/24 1/6   0
Mg2b  7/24   0 1/2
SiE  17/48 5/6   0
SiF  19/48 1/6 1/3
Mg1c 11/24 2/3 5/6
Mg2c 11/24   0 5/6
O1A      0 1/6 1/3
O2A   1/12   0 1/6
O3A   1/12 1/3 1/6
O1B   1/12 2/3 1/6
O2B      0   0 5/6
O3B      0 2/3 5/6
O1C    .25 1/3 1/6
O2C    1/6 1/2 1/3
O3C    1/6 1/6 1/3
O1D    1/6 5/6 1/3
O2D    .25   0 1/6
O3D    .25 2/3 1/6
O1E   5/12 5/6   0
O2E    1/3   0 5/6
O3E    1/3 2/3 5/6
O1F    1/3 1/6 1/3
O2F   5/12   0 1/2
O3F   5/12 1/6   0
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #19a based on stacking sequence ABABCABCBCAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003022
19.595917 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
SiA  1/48 1/3 1/3
Mg1a 1/12 2/3 1/3
Mg2a 1/12 1/2 5/6
SiB  7/48 1/3 1/3
SiC  3/16 2/3   0
Mg1b  .25 1/6 1/6
Mg2b  .25   0 2/3
SiD  5/16 2/3 1/3
SiE 17/48 1/3   0
Mg1c 5/12 2/3   0
Mg2c 5/12   0   0
SiF 23/48 1/3 1/3
O1A 23/24 1/3 1/3
O2A  1/24   0 2/3
O3A  1/24 1/3 2/3
O1B  5/24 1/3 1/3
O2B   1/8   0   0
O3B   1/8 1/6 1/2
O1C   1/8 2/3   0
O2C  5/24   0 1/3
O3C  5/24 2/3 1/3
O1D   3/8 2/3 1/3
O2D  7/24   0   0
O3D  7/24 2/3   0
O1E  7/24 1/3   0
O2E   3/8   0 1/3
O3E   3/8 1/3 1/3
O1F 13/24 1/3 1/3
O2F 11/24   0 2/3
O3F 11/24 1/3 2/3
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #19b based on stacking sequence ABABCABCBCAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003023
19.595917 6 3.4641016 90 90. 90 P2/c
atom    x    y     z
Mg1a    0 5/12   1/4
Mg2a    0  .25   3/4
SiA  1/16 1/12   1/4
SiB  5/48 5/12 11/12
Mg1b  1/6 1/12 11/12
Mg2b  1/6  .25  5/12
SiC 11/48 5/12   1/4
SiD 13/48 1/12  7/12
Mg1c  1/3 5/12 11/12
Mg2c  1/3  .25  5/12
SiE 19/48 1/12 11/12
SiF  7/16 7/12  1/12
Mg1d  1/2 1/12   1/4
Mg2d  1/2  .25   3/4
O1A   1/8 1/12   1/4
O2A  1/24  .25  5/12
O3A  1/24 1/12 11/12
O1B  1/24 7/12  5/12
O2B   1/8  3/4   1/4
O3B   1/8 7/12   3/4
O1C  7/24 5/12   1/4
O2C  5/24  .25  1/12
O3C  5/24 7/12  1/12
O1D  5/24 1/12  7/12
O2D  7/24  .25   3/4
O3D  7/24 1/12   1/4
O1E 11/24 1/12 11/12
O2E   3/8  .25  1/12
O3E   3/8 1/12  7/12
O1F   3/8 7/12  1/12
O2F 11/24  .25  5/12
O3F 11/24 7/12  5/12
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #20a based on stacking sequence ABABCACBACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003024
19.595917 6 3.4641016 90 90. 90 P2/c
atom    x    y     z
Mg1a    0 5/12   1/4
Mg2a    0  .25   3/4
SiA  1/16 1/12 11/12
SiB  5/48 7/12  1/12
Mg1b  1/6 1/12  7/12
Mg2b  1/6  .25  1/12
SiC 11/48 7/12  1/12
SiD 13/48 1/12   1/4
Mg1c  1/3 5/12 11/12
Mg2c  1/3  .25  5/12
SiE  7/16 5/12   1/4
SiF 19/48 1/12 11/12
Mg1d  1/2 1/12   1/4
Mg2d  1/2  .25   3/4
O1A   1/8 1/12 11/12
O2A  1/24  .25  1/12
O3A  1/24 1/12  7/12
O1B  1/24 7/12  1/12
O2B   1/8  .25  5/12
O3B   1/8 7/12  5/12
O1C  7/24 7/12  1/12
O2C  5/24  3/4   1/4
O3C  5/24 5/12   1/4
O1D  5/24 1/12   1/4
O2D  7/24  .25  1/12
O3D  7/24 1/12  7/12
O1E   5/8 5/12   1/4
O2E 13/24  .25  1/12
O3E 13/24 7/12  1/12
O1F 13/24 1/12  7/12
O2F   5/8  .25   3/4
O3F   5/8 1/12   1/4
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #20b based on stacking sequence ABABCACBACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003025
19.595917 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
SiA  1/48 2/3 1/6
Mg1a 1/12 1/6   0
Mg2a 1/12   0 1/2
SiB  7/48 5/6   0
SiC  3/16 1/3 1/6
Mg1b  .25 2/3 1/6
Mg2b  .25   0 1/6
SiD  5/16 1/6   0
SiE 17/48 5/6 1/3
Mg1c 5/12 1/6 1/3
Mg2c 5/12   0 5/6
SiF 23/48 5/6 1/3
O1A 23/24 2/3 1/6
O2A  1/24   0 5/6
O3A  1/24 5/6 1/3
O1B  5/24 5/6   0
O2B   1/8   0 1/6
O3B   1/8 2/3 1/6
O1C   1/8 1/3 1/6
O2C  5/24 1/2   0
O3C  5/24 1/6   0
O1D   3/8 1/6   0
O2D  7/24   0 5/6
O3D  7/24 1/6 1/3
O1E  7/24 5/6 1/3
O2E   3/8 1/2   0
O3E   3/8 5/6   0
O1F 13/24 5/6 1/3
O2F 11/24   0 1/6
O3F 11/24 2/3 1/6
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #21a based on stacking sequence ABABCACBCBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003026
19.595917 6 3.4641016 90 90 90 P2_1cn
atom     x   y   z
SiA   1/48 2/3   0
SiB   1/16 1/6 1/6
Mg1a   1/8 2/3 1/3
Mg2a   1/8   0 1/3
SiC   3/16 1/3   0
SiD  11/48 5/6 1/6
Mg1b  7/24 1/6 1/6
Mg2b  7/24   0 2/3
SiE  17/48 5/6 1/6
SiF  19/48 1/3 1/3
Mg1c 11/24 2/3   0
Mg2c 11/24   0   0
O1A   1/12 2/3   0
O2A      0   0 2/3
O3A      0 2/3 2/3
O1B      0 1/6 1/6
O2B   1/12   0   0
O3B   1/12 1/3   0
O1C    .25 1/3   0
O2C    1/6   0 2/3
O3C    1/6 1/3 2/3
O1D    1/6 5/6 1/6
O2D    .25   0   0
O3D    .25 2/3   0
O1E   5/12 5/6 1/6
O2E    1/3   0 1/3
O3E    1/3 2/3 1/3
O1F    1/3 1/3 1/3
O2F   5/12   0 2/3
O3F   5/12 1/6 1/6
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #21b based on stacking sequence ABABCACBCBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003027
19.595917 6 3.4641016 90 90 90 P2_1cn
atom    x   y   z
Mg1a 1/24 2/3 1/3
Mg2a 1/24 1/2 5/6
SiA  5/48 1/6 1/6
SiB  7/48 2/3   0
Mg1b 5/24 1/6 5/6
Mg2b 5/24   0 1/3
SiC 13/48 2/3 1/3
SiD  5/16 1/3   0
Mg1c  3/8 2/3   0
Mg2c  3/8   0   0
SiE  7/16 1/3 1/3
SiF 23/48 5/6 1/6
O1A   1/6 1/6 1/6
O2A  1/12   0   0
O3A  1/12 1/3   0
O1B  1/12 2/3   0
O2B   1/6   0 2/3
O3B   1/6 2/3 2/3
O1C   1/3 2/3 1/3
O2C   .25   0   0
O3C   .25 2/3   0
O1D   .25 1/3   0
O2D   1/3   0 1/3
O3D   1/3 1/3 1/3
O1E   1/2 1/3 1/3
O2E  5/12   0 2/3
O3E  5/12 1/3 2/3
O1F  5/12 5/6 1/6
O2F   1/2   0 1/3
O3F   1/2 2/3 1/3
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #22a based on stacking sequence ABACBACBACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003028
19.595917 6 3.4641016 90 90. 90 P2/c
atom    x    y     z
Mg1a    0 5/12   1/4
Mg2a    0  .25   3/4
SiA  1/16 1/12   1/4
SiB  5/48 7/12  1/12
Mg1b  1/6 1/12  7/12
Mg2b  1/6  .25  1/12
SiC 11/48 7/12  1/12
SiD 13/48 1/12 11/12
Mg1c  1/3 5/12 11/12
Mg2c  1/3  .25  5/12
SiE 19/48 1/12  7/12
SiF  7/16 5/12   1/4
Mg1d  1/2 1/12   1/4
Mg2d  1/2  .25   3/4
O1A   1/8 1/12   1/4
O2A  1/24  .25  1/12
O3A  1/24 1/12  7/12
O1B  1/24 7/12  1/12
O2B   1/8  3/4   1/4
O3B   1/8 5/12   1/4
O1C  7/24 7/12  1/12
O2C  5/24  .25  5/12
O3C  5/24 7/12  5/12
O1D  5/24 1/12 11/12
O2D  7/24  .25  1/12
O3D  7/24 1/12  7/12
O1E 11/24 1/12  7/12
O2E   3/8  .25   3/4
O3E   3/8 1/12   1/4
O1F   3/8 5/12   1/4
O2F 11/24  .25  1/12
O3F 11/24 7/12  1/12
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #22b based on stacking sequence ABACBACBACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003029
19.595917 6 3.4641016 90 90. 90 P2_1/c
atom    x   y   z
SiA  1/48 5/6 1/6
Mg1a 1/12 1/6 1/6
Mg2a 1/12   0 2/3
SiB  7/48 5/6 1/6
SiC  3/16 1/3   0
Mg1b  .25 2/3   0
Mg2b  .25   0   0
SiD  5/16 1/3   0
SiE 17/48 2/3 1/3
Mg1c 5/12 1/6 1/6
Mg2c 5/12   0 2/3
SiF 23/48 2/3 2/3
O1A 23/24 5/6 1/6
O2A  1/24   0 1/3
O3A  1/24 2/3 1/3
O1B  5/24 5/6 1/6
O2B   1/8   0   0
O3B   1/8 2/3   0
O1C   1/8 1/3   0
O2C  5/24   0 2/3
O3C  5/24 1/6 1/6
O1D   3/8 1/3   0
O2D  7/24   0 1/3
O3D  7/24 1/3 1/3
O1E  7/24 2/3 1/3
O2E   3/8   0   0
O3E   3/8 2/3   0
O1F 13/24 2/3 2/3
O2F 11/24   0 1/3
O3F 11/24 2/3 1/3
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #23 based on stacking sequence ABACBACBCABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003030
19.595917 6 3.4641016 90 90 90 P2_1cn
atom     x   y   z
SiA   1/48 2/3   0
SiB   1/16 1/6 1/6
Mg1a   1/8 2/3 1/3
Mg2a   1/8   0 1/3
SiC   3/16 1/3 1/3
SiD  11/48 5/6 1/6
Mg1b  7/24 1/6 1/6
Mg2b  7/24   0 2/3
SiE  17/48 5/6 1/6
SiF  19/48 1/3   0
Mg1c 11/24 2/3   0
Mg2c 11/24   0   0
O1A   1/12 2/3   0
O2A      0   0 2/3
O3A      0 2/3 2/3
O1B      0 1/6 1/6
O2B   1/12   0   0
O3B   1/12 1/3   0
O1C    .25 1/3 1/3
O2C    1/6   0 2/3
O3C    1/6 1/3 2/3
O1D    1/6 5/6 1/6
O2D    .25   0 1/3
O3D    .25 2/3 1/3
O1E   5/12 5/6 1/6
O2E    1/3   0   0
O3E    1/3 2/3   0
O1F    1/3 1/3   0
O2F   5/12   0 2/3
O3F   5/12 1/6 1/6
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #24 based on stacking sequence ABACBCABACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003031
19.899748 6 3.4641016 90 100.024987862 90 C2/c
atom    x    y     z
Mg1a    0 5/12   3/4
Mg2a    0  .25   1/4
SiA  1/16 1/12 13/16
SiB  5/48 5/12 25/48
Mg1b  1/6 1/12   1/4
Mg2b  1/6  .25   3/4
SiC 11/48 5/12  5/16
O1A   1/8 1/12   7/8
O2A  1/24  .25 23/24
O3A  1/24 1/12 11/24
O1B  1/24 5/12 11/24
O2B   1/8  .25   3/8
O3B   1/8 7/12   3/8
O1C  7/24 5/12   3/8
O2C  5/24  3/4   5/8
O3C  5/24 5/12   5/8
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #25 based on stacking sequence ABABABABABAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003032
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  7/12 1/6
Mg2c 11/24   .25 1/6
SiG  25/48 11/12 5/6
SiH   9/16  7/12 1/2
Mg1d   5/8 11/12 1/6
Mg2d   5/8   .25 1/6
SiJ  11/16  7/12 5/6
SiK  35/48 11/12 1/2
Mg1e 19/24  7/12 1/6
Mg2e 19/24   .25 1/6
SiL  41/48 11/12 1/6
SiM  43/48  7/12 1/2
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 1/3
O2J    2/3   .25 1/2
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 5/6
O3K    3/4  1/12 1/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #26 based on stacking sequence ABABABABACAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003033
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  7/12 1/6
Mg2c 11/24   .25 1/6
SiG  25/48 11/12 5/6
SiH   9/16  7/12 1/2
Mg1d   5/8 11/12 1/6
Mg2d   5/8   .25 1/6
SiJ  11/16  7/12 1/6
SiK  35/48 11/12 1/2
Mg1e 19/24  7/12 5/6
Mg2e 19/24   .25 5/6
SiL  41/48 11/12 1/6
SiM  43/48  7/12 1/2
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 2/3
O2J    2/3   .25 1/2
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #27 based on stacking sequence ABABABABACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003034
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  7/12 1/6
Mg2c 11/24   .25 1/6
SiG  25/48 11/12 5/6
SiH   9/16  7/12 1/2
Mg1d   5/8 11/12 1/6
Mg2d   5/8   .25 1/6
SiJ  11/16  7/12 1/6
SiK  35/48 11/12 1/2
Mg1e 19/24  7/12 1/2
Mg2e 19/24   .25 1/2
SiL  41/48 11/12 1/6
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 2/3
O2J    2/3   .25 1/2
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #28 based on stacking sequence ABABABACABAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003035
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  7/12 1/6
Mg2c 11/24   .25 1/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12   0
Mg1d   5/8  1/12 1/3
Mg2d   5/8   .25 5/6
SiJ  11/16  7/12 5/6
SiK  35/48 11/12 1/2
Mg1e 19/24  7/12 1/6
Mg2e 19/24   .25 1/6
SiL  41/48 11/12 1/6
SiM  43/48  7/12 1/2
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 2/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  5/12 1/3
O2J    2/3   .25 1/2
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 5/6
O3K    3/4  1/12 1/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #29a based on stacking sequence ABABABACACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003036
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  7/12 1/6
Mg2c 11/24   .25 1/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12   0
Mg1d   5/8  1/12 1/3
Mg2d   5/8   .25 5/6
SiJ  11/16  7/12 1/6
SiK  35/48 11/12 1/2
Mg1e 19/24  7/12 1/2
Mg2e 19/24   .25 1/2
SiL  41/48 11/12 1/6
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 2/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  5/12 2/3
O2J    2/3   .25 1/2
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #29b based on stacking sequence ABABABACACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003037
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/2
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 2/3
Mg2c   3/8   .25 1/6
SiE   7/16 11/12 1/2
SiF  23/48  5/12 1/3
Mg1d 13/24  1/12 1/3
Mg2d 13/24   .25 5/6
SiG  29/48  7/12 1/2
SiH  31/48 11/12 1/6
Mg1e 17/24  5/12 1/3
Mg2e 17/24   .25 5/6
SiJ  37/48 11/12 5/6
SiK  13/16  7/12 1/6
Mg1f   7/8  1/12   0
Mg2f   7/8   .25 1/2
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  5/12   0
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/2
O3D    1/3  1/12   0
O1E    1/2  1/12   0
O2E   5/12   .25 5/6
O3E   5/12  1/12 1/3
O1F   5/12  5/12 1/3
O2F    1/2   .25 1/2
O3F    1/2  5/12   0
O1G    2/3  5/12   0
O2G   7/12   .25 1/6
O3G   7/12  7/12 1/6
O1H   7/12  1/12 2/3
O2H    2/3   .25 1/2
O3H    2/3  1/12   0
O1J    5/6  1/12 1/3
O2J    3/4   .25 1/6
O3J    3/4  1/12 2/3
O1K    3/4  7/12 1/6
O2K    5/6   3/4 1/3
O3K    5/6  5/12 1/3
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #30 based on stacking sequence ABABABACBABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003038
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  7/12 1/6
Mg2c 11/24   .25 1/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12   0
Mg1d   5/8  1/12   0
Mg2d   5/8   .25 1/2
SiJ  11/16  5/12   0
SiK  35/48  1/12 1/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48 11/12 1/6
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 2/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  5/12   0
O2J    2/3   3/4 1/3
O3J    2/3  5/12 1/3
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/2
O3K    3/4  1/12   0
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #31 based on stacking sequence ABABABACBCBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003039
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  7/12 1/6
Mg2c 11/24   .25 1/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12   0
Mg1d   5/8  1/12   0
Mg2d   5/8   .25 1/2
SiJ  11/16  5/12 2/3
SiK  35/48  1/12 1/3
Mg1e 19/24  5/12   0
Mg2e 19/24   .25 1/2
SiL  41/48 11/12 1/6
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 2/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  5/12 2/3
O2J    2/3   3/4 1/3
O3J    2/3  5/12 1/3
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #32a based on stacking sequence ABABABCABCAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003040
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  5/12   0
Mg2c 11/24   .25 1/2
SiG  25/48  1/12   0
SiH   9/16  7/12 1/6
Mg1d   5/8  1/12 2/3
Mg2d   5/8   .25 1/6
SiJ  11/16  5/12 2/3
SiK  35/48  1/12 1/3
Mg1e 19/24  7/12 5/6
Mg2e 19/24   .25 5/6
SiL  41/48 11/12 1/6
SiM  43/48  7/12 1/2
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12   0
O2G    1/2   .25 1/6
O3G    1/2  1/12 2/3
O1H    1/2  7/12 1/6
O2H   7/12   3/4   0
O3H   7/12  5/12   0
O1J    3/4  5/12 2/3
O2J    2/3   .25 5/6
O3J    2/3  7/12 5/6
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #32b based on stacking sequence ABABABCABCAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003041
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/2
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 2/3
Mg2c   3/8   .25 1/6
SiE   7/16  1/12 2/3
SiF  23/48  5/12 1/3
Mg1d 13/24  1/12 1/3
Mg2d 13/24   .25 5/6
SiG  29/48  7/12 5/6
SiH  31/48  1/12   0
Mg1e 17/24  5/12   0
Mg2e 17/24   .25 1/2
SiJ  37/48  1/12   0
SiK  13/16  5/12 2/3
Mg1f   7/8  1/12 1/3
Mg2f   7/8   .25 5/6
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  5/12   0
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/2
O3D    1/3  1/12   0
O1E    1/2  1/12 2/3
O2E   5/12   .25 5/6
O3E   5/12  1/12 1/3
O1F   5/12  5/12 1/3
O2F    1/2   .25 1/6
O3F    1/2  5/12 2/3
O1G    2/3  7/12 5/6
O2G   7/12   .25 1/2
O3G   7/12  5/12   0
O1H   7/12  1/12   0
O2H    2/3   .25 5/6
O3H    2/3  1/12 1/3
O1J    5/6  1/12   0
O2J    3/4   .25 1/6
O3J    3/4  1/12 2/3
O1K    3/4  7/12 1/6
O2K    5/6   3/4   0
O3K    5/6  5/12   0
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #33a based on stacking sequence ABABABCABCBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003042
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  5/12   0
Mg2c 11/24   .25 1/2
SiG  25/48  1/12   0
SiH   9/16  7/12 1/6
Mg1d   5/8  1/12 2/3
Mg2d   5/8   .25 1/6
SiJ  11/16  5/12 2/3
SiK  35/48  1/12 1/3
Mg1e 19/24  5/12   0
Mg2e 19/24   .25 1/2
SiL  41/48  1/12 2/3
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12   0
O2G    1/2   .25 1/6
O3G    1/2  1/12 2/3
O1H    1/2  7/12 1/6
O2H   7/12   3/4   0
O3H   7/12  5/12   0
O1J    3/4  5/12 2/3
O2J    2/3   .25 5/6
O3J    2/3  7/12 5/6
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #33b based on stacking sequence ABABABCABCBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003043
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/2
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 2/3
Mg2c   3/8   .25 1/6
SiE   7/16  1/12 2/3
SiF  23/48  5/12 1/3
Mg1d 13/24  1/12 1/3
Mg2d 13/24   .25 5/6
SiG  29/48  7/12 5/6
SiH  31/48  1/12   0
Mg1e 17/24  5/12   0
Mg2e 17/24   .25 1/2
SiJ  37/48  1/12 1/3
SiK  13/16  7/12 1/6
Mg1f   7/8  1/12   0
Mg2f   7/8   .25 1/2
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  5/12   0
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/2
O3D    1/3  1/12   0
O1E    1/2  1/12 2/3
O2E   5/12   .25 5/6
O3E   5/12  1/12 1/3
O1F   5/12  5/12 1/3
O2F    1/2   .25 1/6
O3F    1/2  5/12 2/3
O1G    2/3  7/12 5/6
O2G   7/12   .25 1/2
O3G   7/12  5/12   0
O1H   7/12  1/12   0
O2H    2/3   .25 5/6
O3H    2/3  1/12 1/3
O1J    5/6  1/12 1/3
O2J    3/4   .25 1/6
O3J    3/4  1/12 2/3
O1K    3/4  7/12 1/6
O2K    5/6   .25 5/6
O3K    5/6  5/12 1/3
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #34a based on stacking sequence ABABABCACBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003044
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  5/12   0
Mg2c 11/24   .25 1/2
SiG  25/48  1/12   0
SiH   9/16  7/12 1/6
Mg1d   5/8  1/12 1/3
Mg2d   5/8   .25 5/6
SiJ  11/16  5/12 1/3
SiK  35/48  1/12 2/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48 11/12 1/6
SiM  43/48  7/12 1/2
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12   0
O2G    1/2   .25 1/6
O3G    1/2  1/12 2/3
O1H    1/2  7/12 1/6
O2H   7/12   3/4   0
O3H   7/12  5/12   0
O1J    3/4  5/12 1/3
O2J    2/3   .25 1/6
O3J    2/3  7/12 1/6
O1K    2/3  1/12 2/3
O2K    3/4   .25 5/6
O3K    3/4  1/12 1/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #34b based on stacking sequence ABABABCACBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003045
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/2
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 2/3
Mg2c   3/8   .25 1/6
SiE   7/16  1/12 2/3
SiF  23/48  5/12 1/3
Mg1d 13/24  1/12 1/3
Mg2d 13/24   .25 5/6
SiG  29/48  5/12 2/3
SiH  31/48  1/12   0
Mg1e 17/24  5/12   0
Mg2e 17/24   .25 1/2
SiJ  37/48  1/12   0
SiK  13/16  5/12 1/3
Mg1f   7/8  1/12 1/3
Mg2f   7/8   .25 5/6
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  5/12   0
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/2
O3D    1/3  1/12   0
O1E    1/2  1/12 2/3
O2E   5/12   .25 5/6
O3E   5/12  1/12 1/3
O1F   5/12  5/12 1/3
O2F    1/2   .25 1/6
O3F    1/2  5/12 2/3
O1G    2/3  5/12 2/3
O2G   7/12   .25 1/2
O3G   7/12  5/12   0
O1H   7/12  1/12   0
O2H    2/3   .25 1/6
O3H    2/3  1/12 2/3
O1J    5/6  1/12   0
O2J    3/4   .25 5/6
O3J    3/4  1/12 1/3
O1K    3/4  5/12 1/3
O2K    5/6   3/4   0
O3K    5/6  5/12   0
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #35a based on stacking sequence ABABABCBACAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003046
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  5/12   0
Mg2c 11/24   .25 1/2
SiG  25/48  1/12 1/3
SiH   9/16  7/12 1/6
Mg1d   5/8  1/12 2/3
Mg2d   5/8   .25 1/6
SiJ  11/16  7/12 1/6
SiK  35/48  1/12   0
Mg1e 19/24  7/12 5/6
Mg2e 19/24   .25 5/6
SiL  41/48 11/12 1/6
SiM  43/48  7/12 1/2
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/6
O3G    1/2  1/12 2/3
O1H    1/2  7/12 1/6
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 2/3
O2J    2/3   3/4   0
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #35b based on stacking sequence ABABABCBACAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003047
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/2
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 2/3
Mg2c   3/8   .25 1/6
SiE   7/16  1/12 2/3
SiF  23/48  5/12 1/3
Mg1d 13/24  1/12   0
Mg2d 13/24   .25 1/2
SiG  29/48  5/12   0
SiH  31/48  1/12 1/3
Mg1e 17/24  5/12 1/3
Mg2e 17/24   .25 5/6
SiJ  37/48  1/12   0
SiK  13/16  5/12 2/3
Mg1f   7/8  1/12 1/3
Mg2f   7/8   .25 5/6
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  5/12   0
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/2
O3D    1/3  1/12   0
O1E    1/2  1/12 2/3
O2E   5/12   .25 5/6
O3E   5/12  1/12 1/3
O1F   5/12  5/12 1/3
O2F    1/2   .25 1/6
O3F    1/2  5/12 2/3
O1G    2/3  5/12   0
O2G   7/12   3/4 1/3
O3G   7/12  5/12 1/3
O1H   7/12  1/12 1/3
O2H    2/3   .25 1/2
O3H    2/3  1/12   0
O1J    5/6  1/12   0
O2J    3/4   .25 1/6
O3J    3/4  1/12 2/3
O1K    3/4  7/12 1/6
O2K    5/6   3/4   0
O3K    5/6  5/12   0
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #36 based on stacking sequence ABABACABACAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003048
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 1/6
SiF  19/48  1/12   0
Mg1c 11/24  5/12 1/3
Mg2c 11/24   .25 5/6
SiG  25/48 11/12 5/6
SiH   9/16  7/12 1/2
Mg1d   5/8 11/12 1/6
Mg2d   5/8   .25 1/6
SiJ  11/16  7/12 1/6
SiK  35/48 11/12 1/2
Mg1e 19/24  7/12 5/6
Mg2e 19/24   .25 5/6
SiL  41/48 11/12 1/6
SiM  43/48  7/12 1/2
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 1/6
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 1/6
O3F   5/12  1/12 2/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 2/3
O2J    2/3   .25 1/2
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #37a based on stacking sequence ABABACABACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003049
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 1/6
SiF  19/48  1/12   0
Mg1c 11/24  5/12 1/3
Mg2c 11/24   .25 5/6
SiG  25/48 11/12 5/6
SiH   9/16  7/12 1/2
Mg1d   5/8 11/12 1/6
Mg2d   5/8   .25 1/6
SiJ  11/16  7/12 1/6
SiK  35/48 11/12 1/2
Mg1e 19/24  7/12 1/2
Mg2e 19/24   .25 1/2
SiL  41/48 11/12 1/6
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 1/6
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 1/6
O3F   5/12  1/12 2/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 2/3
O2J    2/3   .25 1/2
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #37b based on stacking sequence ABABACABACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003050
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/2
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 1/3
Mg2c   3/8   .25 5/6
SiE   7/16  1/12   0
SiF  23/48  7/12 1/6
Mg1d 13/24  1/12 2/3
Mg2d 13/24   .25 1/6
SiG  29/48  5/12   0
SiH  31/48  1/12 1/3
Mg1e 17/24  5/12 1/3
Mg2e 17/24   .25 5/6
SiJ  37/48 11/12 5/6
SiK  13/16  7/12 1/6
Mg1f   7/8  1/12   0
Mg2f   7/8   .25 1/2
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  5/12   0
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/2
O3D    1/3  1/12   0
O1E    1/2  1/12   0
O2E   5/12   .25 1/6
O3E   5/12  1/12 2/3
O1F   5/12  7/12 1/6
O2F    1/2   3/4   0
O3F    1/2  5/12   0
O1G    2/3  5/12   0
O2G   7/12   3/4 1/3
O3G   7/12  5/12 1/3
O1H   7/12  1/12 1/3
O2H    2/3   .25 1/2
O3H    2/3  1/12   0
O1J    5/6  1/12 1/3
O2J    3/4   .25 1/6
O3J    3/4  1/12 2/3
O1K    3/4  7/12 1/6
O2K    5/6   3/4 1/3
O3K    5/6  5/12 1/3
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #38a based on stacking sequence ABABACABCABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003051
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 1/6
SiF  19/48  1/12   0
Mg1c 11/24  5/12 1/3
Mg2c 11/24   .25 5/6
SiG  25/48 11/12 5/6
SiH   9/16  7/12 1/2
Mg1d   5/8  1/12   0
Mg2d   5/8   .25 1/2
SiJ  11/16  5/12   0
SiK  35/48  1/12 2/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48 11/12 1/6
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12 7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 1/6
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 1/6
O3F   5/12  1/12 2/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12   0
O2J    2/3   .25 1/6
O3J    2/3  7/12 1/6
O1K    2/3  1/12 2/3
O2K    3/4   .25 1/2
O3K    3/4  1/12   0
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #38b based on stacking sequence ABABACABCABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003052
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/2
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 1/3
Mg2c   3/8   .25 5/6
SiE   7/16  1/12   0
SiF  23/48  7/12 1/6
Mg1d 13/24  1/12 2/3
Mg2d 13/24   .25 1/6
SiG  29/48  7/12 1/6
SiH  31/48  1/12 1/3
Mg1e 17/24  5/12 1/3
Mg2e 17/24   .25 5/6
SiJ  37/48  1/12 1/3
SiK  13/16  5/12   0
Mg1f   7/8  1/12   0
Mg2f   7/8   .25 1/2
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  5/12   0
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/2
O3D    1/3  1/12   0
O1E    1/2  1/12   0
O2E   5/12   .25 1/6
O3E   5/12  1/12 2/3
O1F   5/12  7/12 1/6
O2F    1/2   3/4   0
O3F    1/2  5/12   0
O1G    2/3  7/12 1/6
O2G   7/12   3/4 1/3
O3G   7/12  5/12 1/3
O1H   7/12  1/12 1/3
O2H    2/3   .25 1/6
O3H    2/3  1/12 2/3
O1J    5/6  1/12 1/3
O2J    3/4   .25 1/2
O3J    3/4  1/12   0
O1K    3/4  5/12   0
O2K    5/6   3/4 1/3
O3K    5/6  5/12 1/3
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #39 based on stacking sequence ABABACABCBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003053
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 1/6
SiF  19/48  1/12   0
Mg1c 11/24  5/12 1/3
Mg2c 11/24   .25 5/6
SiG  25/48 11/12 5/6
SiH   9/16  7/12 1/2
Mg1d   5/8  1/12   0
Mg2d   5/8   .25 1/2
SiJ  11/16  5/12 1/3
SiK  35/48  1/12 2/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48  1/12 2/3
SiM  43/48  5/12   0
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 1/6
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 1/6
O3F   5/12  1/12 2/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 1/3
O2J    2/3   .25 1/6
O3J    2/3  7/12 1/6
O1K    2/3  1/12 2/3
O2K    3/4   .25 5/6
O3K    3/4  1/12 1/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #40a based on stacking sequence ABABACACBABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003054
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 1/6
SiF  19/48  1/12   0
Mg1c 11/24  5/12 1/3
Mg2c 11/24   .25 5/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12   0
Mg1d   5/8  1/12   0
Mg2d   5/8   .25 1/2
SiJ  11/16  5/12   0
SiK  35/48  1/12 1/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48 11/12 1/6
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 1/6
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 1/6
O3F   5/12  1/12 2/3
O1G   7/12  1/12 2/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  5/12   0
O2J    2/3   3/4 1/3
O3J    2/3  5/12 1/3
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/2
O3K    3/4  1/12   0
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #40b based on stacking sequence ABABACACBABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003055
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/2
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 1/3
Mg2c   3/8   .25 5/6
SiE   7/16  1/12   0
SiF  23/48  7/12 1/6
Mg1d 13/24  1/12 1/3
Mg2d 13/24   .25 5/6
SiG  29/48  5/12 1/3
SiH  31/48  1/12 2/3
Mg1e 17/24  5/12 2/3
Mg2e 17/24   .25 1/6
SiJ  37/48  1/12 1/3
SiK  13/16  5/12   0
Mg1f   7/8  1/12   0
Mg2f   7/8   .25 1/2
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  5/12   0
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/2
O3D    1/3  1/12   0
O1E    1/2  1/12   0
O2E   5/12   .25 1/6
O3E   5/12  1/12 2/3
O1F   5/12  7/12 1/6
O2F    1/2   3/4   0
O3F    1/2  5/12   0
O1G    2/3  5/12 1/3
O2G   7/12   .25 1/6
O3G   7/12  7/12 1/6
O1H   7/12  1/12 2/3
O2H    2/3   .25 5/6
O3H    2/3  1/12 1/3
O1J    5/6  1/12 1/3
O2J    3/4   .25 1/2
O3J    3/4  1/12   0
O1K    3/4  5/12   0
O2K    5/6   3/4 1/3
O3K    5/6  5/12 1/3
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #41 based on stacking sequence ABABACACBCAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003056
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 1/6
SiF  19/48  1/12   0
Mg1c 11/24  5/12 1/3
Mg2c 11/24   .25 5/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12   0
Mg1d   5/8  1/12   0
Mg2d   5/8   .25 1/2
SiJ  11/16  7/12 1/6
SiK  35/48  1/12 1/3
Mg1e 19/24  5/12 1/3
Mg2e 19/24   .25 5/6
SiL  41/48  1/12 2/3
SiM  43/48  5/12   0
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 1/6
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 1/6
O3F   5/12  1/12 2/3
O1G   7/12  1/12 2/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  7/12 1/6
O2J    2/3   3/4 1/3
O3J    2/3  5/12 1/3
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #42a based on stacking sequence ABABACBABCBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003057
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE 1 7/48  7/12 1/6
SiF  19/48  1/12   0
Mg1c 11/24  5/12   0
Mg2c 11/24   .25 1/2
SiG  25/48  1/12   0
SiH   9/16  5/12 1/3
Mg1d   5/8  1/12 2/3
Mg2d   5/8   .25 1/6
SiJ  11/16  5/12 2/3
SiK  35/48  1/12 1/3
Mg1e 19/24  5/12   0
Mg2e 19/24   .25 1/2
SiL  41/48  1/12 2/3
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 1/6
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 1/6
O3F   5/12  1/12 2/3
O1G   7/12  1/12   0
O2G    1/2   .25 5/6
O3G    1/2  1/12 1/3
O1H    1/2  5/12 1/3
O2H   7/12   3/4   0
O3H   7/12  5/12   0
O1J    3/4  5/12 2/3
O2J    2/3   .25 5/6
O3J    2/3  7/12 5/6
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #42b based on stacking sequence ABABACBABCBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003058
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/2
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 1/3
Mg2c   3/8   .25 5/6
SiE   7/16  1/12 1/3
SiF  23/48  7/12 1/6
Mg1d 13/24  1/12 2/3
Mg2d 13/24   .25 1/6
SiG  29/48  7/12 5/6
SiH  31/48  1/12   0
Mg1e 17/24  5/12   0
Mg2e 17/24   .25 1/2
SiJ  37/48  1/12 1/3
SiK  13/16  7/12 1/6
Mg1f   7/8  1/12   0
Mg2f   7/8   .25 1/2
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  5/12   0
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/2
O3D    1/3  1/12   0
O1E    1/2  1/12 1/3
O2E   5/12   .25 1/6
O3E   5/12  1/12 2/3
O1F   5/12  7/12 1/6
O2F    1/2   3/4 1/3
O3F    1/2  5/12 1/3
O1G    2/3  7/12 5/6
O2G   7/12   .25 1/2
O3G   7/12  5/12   0
O1H   7/12  1/12   0
O2H    2/3   .25 5/6
O3H    2/3  1/12 1/3
O1J    5/6  1/12 1/3
O2J    3/4   .25 1/6
O3J    3/4  1/12 2/3
O1K    3/4  7/12 1/6
O2K    5/6   .25 5/6
O3K    5/6  5/12 1/3
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #43 based on stacking sequence ABABACBACABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003059
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24  .25 1/6
SiE  17/48  7/12 1/6
SiF  19/48  1/12   0
Mg1c 11/24  5/12   0
Mg2c 11/24   .25 1/2
SiG  25/48  1/12   0
SiH   9/16  5/12 1/3
Mg1d   5/8  1/12 1/3
Mg2d   5/8   .25 5/6
SiJ  11/16  5/12   0
SiK  35/48  1/12 2/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48  1/12 2/3
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12  .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 1/6
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 1/6
O3F   5/12  1/12 2/3
O1G   7/12  1/12   0
O2G    1/2   .25 5/6
O3G    1/2  1/12 1/3
O1H    1/2  5/12 1/3
O2H   7/12   3/4   0
O3H   7/12  5/12   0
O1J    3/4  5/12   0
O2J    2/3   .25 1/6
O3J    2/3  7/12 1/6
O1K    2/3  1/12 2/3
O2K    3/4   .25 1/2
O3K    3/4  1/12   0
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #44 based on stacking sequence ABABACBCACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003060
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24 11/12 1/6
Mg2b  7/24   .25 1/6
SiE  17/48  7/12 1/6
SiF  19/48  1/12   0
Mg1c 11/24  5/12   0
Mg2c 11/24   .25 1/2
SiG  25/48  1/12 2/3
SiH   9/16  5/12 1/3
Mg1d   5/8  1/12 1/3
Mg2d   5/8   .25 5/6
SiJ  11/16  7/12 1/6
SiK  35/48  1/12   0
Mg1e 19/24  5/12   0
Mg2e 19/24   .25 1/2
SiL  41/48  1/12 2/3
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 1/6
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 1/6
O3F   5/12  1/12 2/3
O1G   7/12  1/12 2/3
O2G    1/2   .25 5/6
O3G    1/2  1/12 1/3
O1H    1/2  5/12 1/3
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  5/12 2/3
O2J    2/3   3/4   0
O3J    2/3  1/12   0
O1K    2/3  5/12   0
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #45a based on stacking sequence ABABCABABCAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003061
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24  1/12   0
Mg2b  7/24   .25 1/2
SiE  17/48  5/12   0
SiF  19/48  1/12 2/3
Mg1c 11/24  5/12 2/3
Mg2c 11/24   .25 1/6
SiG  25/48  1/12   0
SiH   9/16  5/12 1/3
Mg1d   5/8  1/12 2/3
Mg2d   5/8   .25 1/6
SiJ  11/16  5/12 2/3
SiK  35/48  1/12 1/3
Mg1e 19/24  7/12 5/6
Mg2e 19/24   .25 5/6
SiL  41/48 11/12 1/6
SiM  43/48  7/12 1/2
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12   0
O2E    1/3   .25 1/6
O3E    1/3  7/12 1/6
O1F    1/3  1/12 2/3
O2F   5/12   .25 1/2
O3F   5/12  1/12   0
O1G   7/12  1/12   0
O2G    1/2   .25 5/6
O3G    1/2  1/12 1/3
O1H    1/2  5/12 1/3
O2H   7/12   3/4   0
O3H   7/12  5/12   0
O1J    3/4  5/12 2/3
O2J    2/3   .25 5/6
O3J    2/3  7/12 5/6
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #45b based on stacking sequence ABABCABABCAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003062
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/6
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 1/3
Mg2c   3/8   .25 5/6
SiE   7/16  1/12 1/3
SiF  23/48  5/12   0
Mg1d 13/24  1/12 2/3
Mg2d 13/24   .25 1/6
SiG  29/48  7/12 5/6
SiH  31/48  1/12   0
Mg1e 17/24  5/12   0
Mg2e 17/24   .25 1/2
SiJ  37/48  1/12   0
SiK  13/16  5/12 2/3
Mg1f   7/8  1/12 1/3
Mg2f   7/8   .25 5/6
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  7/12 1/6
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/6
O3D    1/3  1/12 2/3
O1E    1/2  1/12 1/3
O2E   5/12   .25 1/2
O3E   5/12  1/12   0
O1F   5/12  5/12   0
O2F    1/2   3/4 1/3
O3F    1/2  5/12 1/3
O1G    2/3  7/12 5/6
O2G   7/12   .25 1/2
O3G   7/12  5/12   0
O1H   7/12  1/12   0
O2H    2/3   .25 5/6
O3H    2/3  1/12 1/3
O1J    5/6  1/12   0
O2J    3/4   .25 1/6
O3J    3/4  1/12 2/3
O1K    3/4  7/12 1/6
O2K    5/6   3/4   0
O3K    5/6  5/12   0
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #46a based on stacking sequence ABABCABACABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003063
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24  1/12   0
Mg2b  7/24   .25 1/2
SiE  17/48  5/12   0
SiF  19/48  1/12 2/3
Mg1c 11/24  5/12 2/3
Mg2c 11/24   .25 1/6
SiG  25/48  1/12   0
SiH   9/16  5/12 1/3
Mg1d   5/8  1/12 1/3
Mg2d   5/8   .25 5/6
SiJ  11/16  5/12   0
SiK  35/48  1/12 2/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48  1/12 2/3
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12   0
O2E    1/3   .25 1/6
O3E    1/3  7/12 1/6
O1F    1/3  1/12 2/3
O2F   5/12   .25 1/2
O3F   5/12  1/12   0
O1G   7/12  1/12   0
O2G    1/2   .25 5/6
O3G    1/2  1/12 1/3
O1H    1/2  5/12 1/3
O2H   7/12   3/4   0
O3H   7/12  5/12   0
O1J    3/4  5/12   0
O2J    2/3   .25 1/6
O3J    2/3  7/12 1/6
O1K    2/3  1/12 2/3
O2K    3/4   .25 1/2
O3K    3/4  1/12   0
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #46b based on stacking sequence ABABCABACABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003064
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12 0 2
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/6
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 1/3
Mg2c   3/8   .25 5/6
SiE   7/16  1/12 1/3
SiF  23/48  5/12   0
Mg1d 13/24  1/12 2/3
Mg2d 13/24   .25 1/6
SiG  29/48  7/12 1/6
SiH  31/48  1/12   0
Mg1e 17/24  5/12 1/3
Mg2e 17/24   .25 5/6
SiJ  37/48  1/12 1/3
SiK  13/16  5/12   0
Mg1f   7/8  1/12   0
Mg2f   7/8   .25 1/2
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  7/12 1/6
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/6
O3D    1/3  1/12 2/3
O1E    1/2  1/12 1/3
O2E   5/12   .25 1/2
O3E   5/12  1/12   0
O1F   5/12  5/12   0
O2F    1/2   3/4 1/3
O3F    1/2  5/12 1/3
O1G    2/3  7/12 1/6
O2G   7/12   .25 1/2
O3G   7/12  5/12   0
O1H   7/12  1/12   0
O2H    2/3   .25 1/6
O3H    2/3  1/12 2/3
O1J    5/6  1/12 1/3
O2J    3/4   .25 1/2
O3J    3/4  1/12   0
O1K    3/4  5/12   0
O2K    5/6   3/4 1/3
O3K    5/6  5/12 1/3
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #47a based on stacking sequence ABABCABACBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003065
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24  1/12   0
Mg2b  7/24   .25 1/2
SiE  17/48  5/12 0
SiF  19/48  1/12 2/3
Mg1c 11/24  5/12 2/3
Mg2c 11/24   .25 1/6
SiG  25/48  1/12   0
SiH   9/16  5/12 1/3
Mg1d   5/8  1/12 1/3
Mg2d   5/8   .25 5/6
SiJ  11/16  5/12 1/3
SiK  35/48  1/12 2/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48  1/12 2/3
SiM  43/48  5/12   0
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12   0
O2E    1/3   .25 1/6
O3E    1/3  7/12 1/6
O1F    1/3  1/12 2/3
O2F   5/12   .25 1/2
O3F   5/12  1/12   0
O1G   7/12  1/12   0
O2G    1/2   .25 5/6
O3G    1/2  1/12 1/3
O1H    1/2  5/12 1/3
O2H   7/12   3/4   0
O3H   7/12  5/12   0
O1J    3/4  5/12 1/3
O2J    2/3   .25 1/6
O3J    2/3  7/12 1/6
O1K    2/3  1/12 2/3
O2K    3/4   .25 5/6
O3K    3/4  1/12 1/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #47b based on stacking sequence ABABCABACBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003066
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/6
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 1/3
Mg2c   3/8   .25 5/6
SiE   7/16  1/12 1/3
SiF  23/48  5/12   0
Mg1d 13/24  1/12 2/3
Mg2d 13/24   .25 1/6
SiG  29/48  7/12 1/6
SiH  31/48  1/12   0
Mg1e 17/24  5/12   0
Mg2e 17/24   .25 1/2
SiJ  37/48  1/12   0
SiK  13/16  5/12 1/3
Mg1f   7/8  1/12 1/3
Mg2f   7/8   .25 5/6
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  7/12 1/6
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/6
O3D    1/3  1/12 2/3
O1E    1/2  1/12 1/3
O2E   5/12   .25 1/2
O3E   5/12  1/12   0
O1F   5/12  5/12   0
O2F    1/2   3/4 1/3
O3F    1/2  5/12 1/3
O1G    2/3  7/12 1/6
O2G   7/12   .25 1/2
O3G   7/12  5/12   0
O1H   7/12  1/12   0
O2H    2/3   .25 1/6
O3H    2/3  1/12 2/3
O1J    5/6  1/12   0
O2J    3/4   .25 5/6
O3J    3/4  1/12 1/3
O1K    3/4  5/12 1/3
O2K    5/6   3/4   0
O3K    5/6  5/12   0
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #48a based on stacking sequence ABABCABCABAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003067
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24  1/12   0
Mg2b  7/24   .25 1/2
SiE  17/48  5/12   0
SiF  19/48  1/12 2/3
Mg1c 11/24  5/12 2/3
Mg2c 11/24   .25 1/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12 1/3
Mg1d   5/8  1/12 1/3
Mg2d   5/8   .25 5/6
SiJ  11/16  5/12 1/3
SiK  35/48  1/12   0
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48  1/12 2/3
SiM  43/48  5/12   0
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12   0
O2E    1/3   .25 1/6
O3E    1/3  7/12 1/6
O1F    1/3  1/12 2/3
O2F   5/12   .25 1/2
O3F   5/12  1/12   0
O1G   7/12  1/12 2/3
O2G    1/2   .25 5/6
O3G    1/2  1/12 1/3
O1H    1/2  5/12 1/3
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  5/12 1/3
O2J    2/3   3/4   0
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 5/6
O3K    3/4  1/12 1/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #48b based on stacking sequence ABABCABCABAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003068
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/6
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 1/3
Mg2c   3/8   .25 5/6
SiE   7/16  1/12 1/3
SiF  23/48  5/12   0
Mg1d 13/24  1/12   0
Mg2d 13/24   .25 1/2
SiG  29/48  5/12   0
SiH  31/48  1/12 2/3
Mg1e 17/24  5/12 2/3
Mg2e 17/24   .25 1/6
SiJ  37/48  1/12   0
SiK  13/16  5/12 1/3
Mg1f   7/8  1/12 1/3
Mg2f   7/8   .25 5/6
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  7/12 1/6
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/6
O3D    1/3  1/12 2/3
O1E    1/2  1/12 1/3
O2E   5/12   .25 1/2
O3E   5/12  1/12   0
O1F   5/12  5/12   0
O2F    1/2   3/4 1/3
O3F    1/2  5/12 1/3
O1G    2/3  5/12   0
O2G   7/12   .25 1/6
O3G   7/12  7/12 1/6
O1H   7/12  1/12 2/3
O2H    2/3   .25 1/2
O3H    2/3  1/12   0
O1J    5/6  1/12   0
O2J    3/4   .25 5/6
O3J    3/4  1/12 1/3
O1K    3/4  5/12 1/3
O2K    5/6   3/4   0
O3K    5/6  5/12   0
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #49a based on stacking sequence ABABCABCACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003069
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24  1/12   0
Mg2b  7/24   .25 1/2
SiE  17/48  5/12   0
SiF  19/48  1/12 2/3
Mg1c 11/24  5/12 2/3
Mg2c 11/24   .25 1/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12 1/3
Mg1d   5/8  1/12 1/3
Mg2d   5/8   .25 5/6
SiJ  11/16  7/12 1/6
SiK  35/48  1/12   0
Mg1e 19/24  5/12   0
Mg2e 19/24   .25 1/2
SiL  41/48  1/12 2/3
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12  .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12   0
O2E    1/3   .25 1/6
O3E    1/3  7/12 1/6
O1F    1/3  1/12 2/3
O2F   5/12   .25 1/2
O3F   5/12  1/12   0
O1G   7/12  1/12 2/3
O2G    1/2   .25 5/6
O3G    1/2  1/12 1/3
O1H    1/2  5/12 1/3
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  7/12 1/6
O2J    2/3   3/4   0
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #49b based on stacking sequence ABABCABCACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003070
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/6
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12 1/3
Mg2c   3/8   .25 5/6
SiE   7/16  1/12 1/3
SiF  23/48  5/12   0
Mg1d 13/24  1/12   0
Mg2d 13/24   .25 1/2
SiG  29/48  5/12   0
SiH  31/48  1/12 2/3
Mg1e 17/24  5/12 1/3
Mg2e 17/24   .25 5/6
SiJ  37/48  1/12 1/3
SiK  13/16  7/12 1/6
Mg1f   7/8  1/12   0
Mg2f   7/8   .25 1/2
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  7/12 1/6
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/6
O3D    1/3  1/12 2/3
O1E    1/2  1/12 1/3
O2E   5/12   .25 1/2
O3E   5/12  1/12   0
O1F   5/12  5/12   0
O2F    1/2   3/4 1/3
O3F    1/2  5/12 1/3
O1G    2/3  5/12   0
O2G   7/12   .25 1/6
O3G   7/12  7/12 1/6
O1H   7/12  1/12 2/3
O2H    2/3   .25 1/2
O3H    2/3  1/12   0
O1J    5/6  1/12 1/3
O2J    3/4   .25 1/6
O3J    3/4  1/12 2/3
O1K    3/4  7/12 1/6
O2K    5/6   3/4 1/3
O3K    5/6  5/12 1/3
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #50 based on stacking sequence ABABCACBABAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003071
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24  1/12   0
Mg2b  7/24   .25 1/2
SiE  17/48  5/12   0
SiF  19/48  1/12 2/3
Mg1c 11/24  5/12 1/3
Mg2c 11/24   .25 5/6
SiG  25/48  1/12 1/3
SiH   9/16  7/12 1/6
Mg1d   5/8  1/12 2/3
Mg2d   5/8   .25 1/6
SiJ  11/16  5/12 1/3
SiK  35/48  1/12   0
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48  1/12 2/3
SiM  43/48  5/12   0
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12   0
O2E    1/3   .25 1/6
O3E    1/3  7/12 1/6
O1F    1/3  1/12 2/3
O2F   5/12   .25 1/2
O3F   5/12  1/12   0
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/6
O3G    1/2  1/12 2/3
O1H    1/2  7/12 1/6
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 1/3
O2J    2/3   3/4   0
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 5/6
O3K    3/4  1/12 1/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #51a based on stacking sequence ABABCBABCBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003072
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24  1/12   0
Mg2b  7/24   .25 1/2
SiE  17/48  7/12 5/6
SiF  19/48  1/12 2/3
Mg1c 11/24  5/12 2/3
Mg2c 11/24   .25 1/6
SiG  25/48 11/12 5/6
SiH   9/16  7/12 1/2
Mg1d   5/8  1/12   0
Mg2d   5/8   .25 1/2
SiJ  11/16  5/12 1/3
SiK  35/48  1/12 2/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48  1/12 2/3
SiM  43/48  5/12   0
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  7/12 5/6
O2E    1/3   .25 1/6
O3E    1/3  7/12 1/6
O1F    1/3  1/12 2/3
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 1/3
O2J    2/3   .25 1/6
O3J    2/3  7/12 1/6
O1K    2/3  1/12 2/3
O2K    3/4   .25 5/6
O3K    3/4  1/12 1/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
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Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #51b based on stacking sequence ABABCBABCBAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003073
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
Mg1a  1/24  7/12 1/6
Mg2a  1/24   .25 1/6
SiA   5/48  1/12   0
SiB   7/48  5/12 1/3
Mg1b  5/24  1/12 2/3
Mg2b  5/24   .25 1/6
SiC  13/48  7/12 1/6
SiD   5/16  1/12 1/3
Mg1c   3/8  5/12   0
Mg2c   3/8   .25 1/2
SiE   7/16  1/12   0
SiF  23/48  5/12 1/3
Mg1d 13/24  1/12 2/3
Mg2d 13/24   .25 1/6
SiG  29/48  7/12 1/6
SiH  31/48  1/12 1/3
Mg1e 17/24  5/12   0
Mg2e 17/24   .25 1/2
SiJ  37/48  1/12   0
SiK  13/16  5/12 1/3
Mg1f   7/8  1/12 1/3
Mg2f   7/8   .25 5/6
SiL  15/16  7/12 1/2
SiM  47/48 11/12 1/6
O1A    1/6  1/12   0
O2A   1/12   .25 5/6
O3A   1/12  1/12 1/3
O1B   1/12  5/12 1/3
O2B    1/6   .25 1/2
O3B    1/6  5/12   0
O1C    1/3  7/12 1/6
O2C    .25   3/4 1/3
O3C    .25  5/12 1/3
O1D    .25  1/12 1/3
O2D    1/3   .25 1/6
O3D    1/3  1/12 2/3
O1E    1/2  1/12   0
O2E   5/12   .25 5/6
O3E   5/12  1/12 1/3
O1F   5/12  5/12 1/3
O2F    1/2   3/4   0
O3F    1/2  5/12   0
O1G    2/3  7/12 1/6
O2G   7/12   3/4 1/3
O3G   7/12  5/12 1/3
O1H   7/12  1/12 1/3
O2H    2/3   .25 1/6
O3H    2/3  1/12 2/3
O1J    5/6  1/12   0
O2J    3/4   .25 5/6
O3J    3/4  1/12 1/3
O1K    3/4  5/12 1/3
O2K    5/6   3/4   0
O3K    5/6  5/12   0
O1L      0  5/12   0
O2L  11/12   .25 1/6
O3L  11/12  7/12 1/6
O1M  11/12  1/12 2/3
O2M      0   .25 1/2
O3M      0  1/12   0
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #52 based on stacking sequence ABABCBACBCAC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003074
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16 11/12 5/6
SiD  11/48  7/12 1/2
Mg1b  7/24  1/12   0
Mg2b  7/24   .25 1/2
SiE  17/48  5/12 1/3
SiF  19/48  1/12 2/3
Mg1c 11/24  5/12 2/3
Mg2c 11/24   .25 1/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12   0
Mg1d   5/8  1/12   0
Mg2d   5/8   .25 1/2
SiJ  11/16  7/12 1/6
SiK  35/48  1/12 1/3
Mg1e 19/24  5/12 1/3
Mg2e 19/24   .25 5/6
SiL  41/48  1/12 2/3
SiM  43/48  5/12   0
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12 7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 1/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 5/6
O3D    .25  5/12 1/3
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/6
O3E    1/3  7/12 1/6
O1F    1/3  1/12 2/3
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 2/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  7/12 1/6
O2J    2/3   3/4 1/3
O3J    2/3  5/12 1/3
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 1/2
O3L    5/6  1/12   0
O1M    5/6  5/12   0
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #53 based on stacking sequence ABACABACBABC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003075
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16  1/12 2/3
SiD  11/48  5/12   0
Mg1b  7/24  1/12 1/3
Mg2b  7/24   .25 5/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  7/12 1/6
Mg2c 11/24   .25 1/6
SiG  25/48  1/12 2/3
SiH   9/16  5/12   0
Mg1d   5/8  1/12   0
Mg2d   5/8   .25 1/2
SiJ  11/16  5/12   0
SiK  35/48  1/12 1/3
Mg1e 19/24  5/12 2/3
Mg2e 19/24   .25 1/6
SiL  41/48 11/12 1/6
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 2/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 1/6
O3D    .25  7/12 1/6
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 2/3
O2G    1/2   .25 1/2
O3G    1/2  1/12   0
O1H    1/2  5/12   0
O2H   7/12   .25 1/6
O3H   7/12  7/12 1/6
O1J    3/4  5/12   0
O2J    2/3   3/4 1/3
O3J    2/3  5/12 1/3
O1K    2/3  1/12 1/3
O2K    3/4   .25 1/2
O3K    3/4  1/12   0
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol88/AM88_653.pdf
American Mineralogist 88 (2003) 653-666
Model pyroxenes I: Ideal pyroxene topologies
Pyroxene #54 based on stacking sequence ABACABCBACBC
Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.
_database_code_amcsd 0003076
19.595917 6 3.4641016 90 90. 90 Pc
atom     x     y   z
SiA   1/48  7/12 5/6
SiB   1/16 11/12 1/2
Mg1a   1/8  7/12 1/6
Mg2a   1/8   .25 1/6
SiC   3/16  1/12 2/3
SiD  11/48  5/12   0
Mg1b  7/24  1/12 1/3
Mg2b  7/24   .25 5/6
SiE  17/48  7/12 5/6
SiF  19/48 11/12 1/2
Mg1c 11/24  5/12   0
Mg2c 11/24   .25 1/2
SiG  25/48  1/12 1/3
SiH   9/16  7/12 1/6
Mg1d   5/8  1/12 2/3
Mg2d   5/8   .25 1/6
SiJ  11/16  7/12 1/6
SiK  35/48  1/12   0
Mg1e 19/24  5/12   0
Mg2e 19/24   .25 1/2
SiL  41/48  1/12 2/3
SiM  43/48  5/12 1/3
Mg1f 23/24 11/12 5/6
Mg2f 23/24   .25 5/6
O1A   1/12  7/12 5/6
O2A      0   3/4   0
O3A      0  5/12   0
O1B      0  1/12   0
O2B   1/12   .25 5/6
O3B   1/12  1/12 1/3
O1C    .25  1/12 2/3
O2C    1/6   .25 1/2
O3C    1/6  1/12   0
O1D    1/6  5/12   0
O2D    .25   .25 1/6
O3D    .25  7/12 1/6
O1E   5/12  5/12 1/3
O2E    1/3   .25 1/2
O3E    1/3  7/12 1/2
O1F    1/3  1/12   0
O2F   5/12   .25 5/6
O3F   5/12  1/12 1/3
O1G   7/12  1/12 1/3
O2G    1/2   .25 1/6
O3G    1/2  1/12 2/3
O1H    1/2  7/12 1/6
O2H   7/12   3/4 1/3
O3H   7/12  5/12 1/3
O1J    3/4  5/12 2/3
O2J    2/3   3/4   0
O3J    2/3  5/12   0
O1K    2/3  1/12   0
O2K    3/4   .25 1/6
O3K    3/4  1/12 2/3
O1L  11/12  1/12 2/3
O2L    5/6   .25 5/6
O3L    5/6  1/12 1/3
O1M    5/6  5/12 1/3
O2M  11/12   .25 1/6
O3M  11/12  7/12 1/6
Download AMC data (View Text File)
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 0.0001 GPa
Note: altered y-coordinate of O2
_database_code_amcsd 0003133
9.5720 8.7094 5.2678 90 107.498 90 C2/c
atom      x      y     z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Na2       0  .2999   .25 1.55  .0051  .0045  .0122      0 -.0005      0
Cr1       0 .90769   .25  .91 .00277  .0030  .0078      0  .0005      0
Si   .29259  .0918 .2343  .92  .0028  .0031  .0081  .0000  .0008  .0000
O1    .1137  .0784 .1366 1.01  .0027  .0038  .0081 -.0002  .0004  .0004
O2    .3605  .2589 .3033 1.25  .0038  .0039  .0123 -.0005  .0014 -.0001
O3    .3529  .0095 .0092 1.14  .0035  .0040  .0097  .0006  .0014 -.0002
Download AMC data (View Text File)
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 1.14 GPa
_database_code_amcsd 0003134
9.5439 8.6831 5.2517 90 107.441 90 C2/c
atom     x     y     z Biso
Na2      0 .3006   .25 1.80
Cr1      0 .9082   .25 1.23
Si   .2925 .0921 .2342 1.29
O1   .1144 .0798  .138 1.34
O2   .3614 .2583  .306  1.4
O3   .3527 .0109  .007 1.45
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 2.22 GPa
_database_code_amcsd 0003135
9.5173 8.6605 5.2374 90 107.349 90 C2/c
atom     x     y     z Biso
Na2      0 .3005   .25  1.5
Cr1      0 .9079   .25  .78
Si   .2927 .0922 .2344  .92
O1   .1149 .0793  .136  1.0
O2   .3606 .2585  .307  1.1
O3   .3548 .0114  .008  1.1
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 3.53 GPa
_database_code_amcsd 0003136
9.4867 8.6323 5.2206 90 107.221 90 C2/c
atom     x     y     z Biso
Na2      0 .3020   .25  1.4
Cr1      0 .9084   .25  .93
Si   .2928 .0922 .2347  .93
O1   .1146 .0802  .140  1.2
O2   .3604 .2605  .308  1.2
O3   .3535 .0142  .008  0.9
Download AMC data (View Text File)
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 5.05 GPa
_database_code_amcsd 0003137
9.4562 8.5997 5.2016 90 107.104 90 C2/c
atom     x     y     z Biso
Na2      0 .3031   .25  1.5
Cr1      0 .9088   .25  .78
Si   .2924 .0936 .2343  .95
O1    .116 .0799  .139  0.9
O2    .360 .2611  .310  1.0
O3    .359 .0131  .005  1.0
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 5.78 GPa
_database_code_amcsd 0003138
9.4350 8.5780 5.1894 90 107.030 90 C2/c
atom     x     y     z Biso
Na2      0  .303   .25  1.2
Cr1      0 .9091   .25  .76
Si   .2926 .0934 .2344  .64
O1    .114  .082  .137  0.8
O2    .362  .261  .314  0.8
O3    .353 .0162  .004  0.8
Download AMC data (View Text File)
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 6.25 GPa
_database_code_amcsd 0003139
9.4295 8.5700 5.1844 90 106.999 90 C2/c
atom     x     y     z Biso
Na2      0 .3034   .25  1.3
Cr1      0 .9087   .25  .80
Si   .2929 .0935 .2343  .86
O1    .115 .0805  .138  0.8
O2    .362 .2622  .313  1.1
O3    .354 .0150  .002  0.9
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 7.08 GPa
_database_code_amcsd 0003140
9.4110 8.5517 5.1729 90 106.910 90 C2/c
atom     x     y     z Biso
Na2      0 .3058   .25  1.3
Cr1      0 .9088   .25  .84
Si   .2927 .0936 .2355  .95
O1    .116 .0813  .140  0.8
O2    .362 .2627  .313  1.2
O3    .358 .0172  .002 1.07
Download AMC data (View Text File)
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 7.23 GPa
_database_code_amcsd 0003141
9.4105 8.5481 5.1727 90 106.915 90 C2/c
atom     x     y     z Biso
Na2      0 .3025   .25  1.2
Cr1      0 .9086   .25  .69
Si   .2929 .0933 .2348  .70
O1   .1148 .0820  .141  0.8
O2   .3588 .2624  .312  0.8
O3   .3570 .0161  .003  0.9
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 7.39 GPa
_database_code_amcsd 0003142
9.4059 8.5472 5.1703 90 106.892 90 C2/c
atom     x     y     z Biso
Na2      0 .3053   .25  1.3
Cr1      0 .9089   .25  .77
Si   .2933 .0934 .2356  .79
O1    .116 .0812  .139  0.9
O2    .358 .2637  .311  1.0
O3    .358 .0165  .002  0.9
Download AMC data (View Text File)
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 8.50 GPa
_database_code_amcsd 0003143
9.3836 8.5201 5.1560 90 106.776 90 C2/c
atom     x     y     z Biso
Na2      0  .303   .25  1.2
Cr1      0 .9092   .25  .74
Si   .2936 .0932 .2352  .77
O1   .1136  .079  .138  0.8
O2    .360  .264  .313  1.0
O3    .355  .017  .002  0.7
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 8.97 GPa
_database_code_amcsd 0003144
9.3742 8.5086 5.1484 90 106.721 90 C2/c
atom     x     y     z Biso
Na2      0  .304   .25  1.4
Cr1      0 .9096   .25  .83
Si   .2936 .0938 .2350  .75
O1   .1142  .080  .139  0.8
O2    .359  .264  .314  1.1
O3    .357  .018  .004  0.8
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Kosmochlor
Download hom/kosmochlor.pdf
Origlieri M J, Downs R T, Thompson R M, Pommier C J S, Denton M B, Harlow G E
Download am/vol88/AM88_1025.pdf
American Mineralogist 88 (2003) 1025-1032
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
anisotropic compression in pyroxenes
Sample: P = 9.28 GPa
_database_code_amcsd 0003145
9.3694 8.5028 5.1456 90 106.717 90 C2/c
atom     x     y     z Biso
Na2      0 .3044   .25  1.2
Cr1      0 .9094   .25  .70
Si   .2935 .0933 .2363  .72
O1   .1142  .081  .138  0.7
O2   .3585  .264  .314  0.9
O3   .3560 .0184  .000  0.7
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Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol89/AM89_614.pdf
American Mineralogist 89 (2004) 614-628
Model pyroxenes II: Structural variation as a function of tetrahedral rotation
model with O3-O3-O3 angle = 240 and model oxygen radius = 1
Note: Atoms Mg, Si, and O are assigned to atomic positions for convenience
_database_code_amcsd 0003471
7.394 6 3.464 90 117.9 90 C2/c
atom     x      y      z
Mg1      0  11/12    1/4
Mg2      0    .25    1/4
Si    5/16   1/12  19/48
O1     1/8   1/12   5/24
O2     3/8    .25   7/24
O3     3/8  11/12   7/24
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Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol89/AM89_614.pdf
American Mineralogist 89 (2004) 614-628
Model pyroxenes II: Structural variation as a function of tetrahedral rotation
model with O3-O3-O3 angle = 220 and model oxygen radius = 1
Note: Atoms Mg, Si, and O are assigned to atomic positions for convenience
_database_code_amcsd 0003472
7.565 6.510 3.759 90 115.8 90 C2/c
atom     x      y      z
Mg1      0  11/12    1/4
Mg2      0    .25    1/4
Si   .3100   1/12  .3551
O1   .1301   1/12  .1974
O2   .3699    .25  .3026
O3   .3699 -.0525  .2101
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Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol89/AM89_614.pdf
American Mineralogist 89 (2004) 614-628
Model pyroxenes II: Structural variation as a function of tetrahedral rotation
model with O3-O3-O3 angle = 200 and model oxygen radius = 1
Note: Atoms Mg, Si, and O are assigned to atomic positions for convenience
_database_code_amcsd 0003473
7.608 6.823 3.939 90 113.4 90 C2/c
atom     x      y      z
Mg1      0  11/12    1/4
Mg2      0    .25    1/4
Si   .3085   1/12  .3204
O1   .1330   1/12  .1856
O2   .3670    .25  .3144
O3   .3670 -.0255  .1408
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Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol89/AM89_614.pdf
American Mineralogist 89 (2004) 614-628
Model pyroxenes II: Structural variation as a function of tetrahedral rotation
model with O3-O3-O3 angle = 180 and model oxygen radius = 1
Note: Atoms Mg, Si, and O are assigned to atomic positions for convenience
_database_code_amcsd 0003474
7.526 6.928 4 90 110.8 90 C2/c
atom     x      y      z
Mg1      0  11/12    1/4
Mg2      0    .25    1/4
Si   .3080   1/12  .2887
O1   .1340   1/12  .1726
O2   .3660    .25  .3274
O3   .3660      0  .0774
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Pyroxene-ideal
 
Thompson R M, Downs R T
Download am/vol89/AM89_614.pdf
American Mineralogist 89 (2004) 614-628
Model pyroxenes II: Structural variation as a function of tetrahedral rotation
model with O3-O3-O3 angle = 160 and model oxygen radius = 1
Note: Atoms Mg, Si, and O are assigned to atomic positions for convenience
_database_code_amcsd 0003475
7.326 6.823 3.939 90 107.7 90 C2/c
atom     x      y      z
Mg1      0  11/12    1/4
Mg2      0    .25    1/4
Si   .3085   1/12  .2576
O1   .1330   1/12  .1585
O2   .3670    .25  .3415
O3   .3670  .0255  .0152
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View JMOL 3-D Structure
 
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Total number of retrieved datasets: 191
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Number of datasets in this page:100


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