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Enstatite |
 |
Smyth J R, Mierdel K, Keppler H, Langenhorst F, Dubrovinsky L, Nestola F |
| |
American Mineralogist 92 (2007) 973-976 |
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Crystal chemistry of hydration in aluminous orthopyroxene |
|
Locality: synthetic |
|
_database_code_amcsd 0004362 |
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18.1876 8.7352 5.1789 90 90 90 Pbca |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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MgM2 .37904 .48367 .35223 .958 .0086 .0104 .0101 .0054 -.0012 -.0020 .0000 |
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MgM1 .37604 .65378 .86086 .79 .0061 .0062 .0080 .0042 -.0001 -.0009 -.0002 |
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AlM1 .37604 .65378 .86086 .21 .0061 .0062 .0080 .0042 -.0001 -.0009 -.0002 |
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Si1 .27135 .34230 .04527 .0058 .0056 .0080 .0039 -.0006 -.0001 .0002 |
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Si2 .47307 .33717 .80610 .75 .0075 .0068 .0097 .0060 .0001 .0002 .0004 |
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Al2 .47307 .33717 .80610 .25 .0075 .0068 .0097 .0060 .0001 .0002 .0004 |
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O1a .18267 .3391 .0325 .0082 .0057 .0117 .0072 -.0012 -.0010 .0016 |
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O2a .31066 .5049 .0380 .0082 .0084 .0102 .0061 -.0020 -.0005 .0002 |
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O3a .30260 .2233 -.1737 .0083 .0079 .0121 .0051 -.0003 .0001 -.0017 |
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O1b .56356 .3374 .8088 .0090 .0077 .0114 .0079 -.0008 .0016 .0020 |
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O2b .43269 .4854 .6889 .0093 .0091 .0132 .0055 -.0017 -.0011 .0004 |
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O3b .44653 .1910 .6142 .0093 .0079 .0108 .0092 .0002 .0010 -.0023 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
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Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 298 K |
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_database_code_amcsd 0008038 |
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4.2110 4.2110 4.2110 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 455 K |
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_database_code_amcsd 0008039 |
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4.2181 4.2181 4.2181 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 710 K |
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_database_code_amcsd 0008040 |
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4.2318 4.2318 4.2318 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
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|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 905 K |
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_database_code_amcsd 0008041 |
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4.2483 4.2483 4.2483 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1096 K |
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_database_code_amcsd 0008042 |
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4.2576 4.2576 4.2576 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
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|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1205 K |
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_database_code_amcsd 0008043 |
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4.2665 4.2665 4.2665 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1305 K |
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_database_code_amcsd 0008044 |
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4.2703 4.2703 4.2703 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1365 K |
|
_database_code_amcsd 0008045 |
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4.2736 4.2736 4.2736 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1527 K |
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_database_code_amcsd 0008046 |
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4.2820 4.2820 4.2820 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1598 K |
|
_database_code_amcsd 0008047 |
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4.2924 4.2924 4.2924 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1685 K |
|
_database_code_amcsd 0008048 |
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4.2993 4.2993 4.2993 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1870 K |
|
_database_code_amcsd 0008049 |
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4.3089 4.3089 4.3089 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1915 K |
|
_database_code_amcsd 0008050 |
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4.3141 4.3141 4.3141 90 90 90 Fm3m |
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atom x y z |
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Mg 0 0 0 |
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O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2055 K |
|
_database_code_amcsd 0008051 |
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4.3272 4.3272 4.3272 90 90 90 Fm3m |
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atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2106 K |
|
_database_code_amcsd 0008052 |
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4.3305 4.3305 4.3305 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2245 K |
|
_database_code_amcsd 0008053 |
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4.3425 4.3425 4.3425 90 90 90 Fm3m |
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atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2297 K |
|
_database_code_amcsd 0008054 |
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4.3481 4.3481 4.3481 90 90 90 Fm3m |
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atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2395 K |
|
_database_code_amcsd 0008055 |
|
4.3554 4.3554 4.3554 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2408 K |
|
_database_code_amcsd 0008056 |
|
4.3564 4.3564 4.3564 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2592 K |
|
_database_code_amcsd 0008057 |
|
4.3741 4.3741 4.3741 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2703 K |
|
_database_code_amcsd 0008058 |
|
4.3842 4.3842 4.3842 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2785 K |
|
_database_code_amcsd 0008059 |
|
4.3915 4.3915 4.3915 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2848 K |
|
_database_code_amcsd 0008060 |
|
4.3971 4.3971 4.3971 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2912 K |
|
_database_code_amcsd 0008061 |
|
4.4041 4.4041 4.4041 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2986 K |
|
_database_code_amcsd 0008062 |
|
4.4112 4.4112 4.4112 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3031 K |
|
_database_code_amcsd 0008063 |
|
4.4195 4.4195 4.4195 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3065 K |
|
_database_code_amcsd 0008064 |
|
4.4424 4.4424 4.4424 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3086 K |
|
_database_code_amcsd 0008065 |
|
4.4453 4.4453 4.4453 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3040 K |
|
_database_code_amcsd 0008066 |
|
4.4403 4.4403 4.4403 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3015 K |
|
_database_code_amcsd 0008067 |
|
4.4166 4.4166 4.4166 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 298 K |
|
_database_code_amcsd 0008068 |
|
3.1648 3.1648 3.1648 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 455 K |
|
_database_code_amcsd 0008069 |
|
3.1672 3.1672 3.1672 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 905 K |
|
_database_code_amcsd 0008070 |
|
3.1731 3.1731 3.1731 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 918 K |
|
_database_code_amcsd 0008071 |
|
3.1738 3.1738 3.1738 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1205 K |
|
_database_code_amcsd 0008072 |
|
3.1775 3.1775 3.1775 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1363 K |
|
_database_code_amcsd 0008073 |
|
3.1804 3.1804 3.1804 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1410 K |
|
_database_code_amcsd 0008074 |
|
3.1822 3.1822 3.1822 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1527 K |
|
_database_code_amcsd 0008075 |
|
3.1837 3.1837 3.1837 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1537 K |
|
_database_code_amcsd 0008076 |
|
3.1824 3.1824 3.1824 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1685 K |
|
_database_code_amcsd 0008077 |
|
3.1866 3.1866 3.1866 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1846 K |
|
_database_code_amcsd 0008078 |
|
3.1913 3.1913 3.1913 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 1870 K |
|
_database_code_amcsd 0008079 |
|
3.1908 3.1908 3.1908 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2032 K |
|
_database_code_amcsd 0008080 |
|
3.1926 3.1926 3.1926 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2171 K |
|
_database_code_amcsd 0008081 |
|
3.1946 3.1946 3.1946 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2310 K |
|
_database_code_amcsd 0008082 |
|
3.1979 3.1979 3.1979 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2450 K |
|
_database_code_amcsd 0008083 |
|
3.2026 3.2026 3.2026 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2620 K |
|
_database_code_amcsd 0008084 |
|
3.2079 3.2079 3.2079 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2720 K |
|
_database_code_amcsd 0008085 |
|
3.2094 3.2094 3.2094 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2774 K |
|
_database_code_amcsd 0008086 |
|
3.2116 3.2116 3.2116 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2830 K |
|
_database_code_amcsd 0008087 |
|
3.2134 3.2134 3.2134 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2929 K |
|
_database_code_amcsd 0008088 |
|
3.2165 3.2165 3.2165 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3130 K |
|
_database_code_amcsd 0008089 |
|
3.2219 3.2219 3.2219 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3190 K |
|
_database_code_amcsd 0008090 |
|
3.2238 3.2238 3.2238 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3316 K |
|
_database_code_amcsd 0008091 |
|
3.2275 3.2275 3.2275 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3470 K |
|
_database_code_amcsd 0008092 |
|
3.2332 3.2332 3.2332 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3548 K |
|
_database_code_amcsd 0008093 |
|
3.2358 3.2358 3.2358 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3430 K |
|
_database_code_amcsd 0008094 |
|
3.2300 3.2300 3.2300 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 3220 K |
|
_database_code_amcsd 0008095 |
|
3.2248 3.2248 3.2248 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2986 K |
|
_database_code_amcsd 0008096 |
|
3.2166 3.2166 3.2166 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2785 K |
|
_database_code_amcsd 0008097 |
|
3.2131 3.2131 3.2131 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2650 K |
|
_database_code_amcsd 0008098 |
|
3.2099 3.2099 3.2099 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2592 K |
|
_database_code_amcsd 0008099 |
|
3.2087 3.2087 3.2087 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2395 K |
|
_database_code_amcsd 0008100 |
|
3.2015 3.2015 3.2015 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2245 K |
|
_database_code_amcsd 0008101 |
|
3.1979 3.1979 3.1979 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Tungsten |
| |
Dubrovinsky L S, Saxena S K |
| |
Physics and Chemistry of Minerals 24 (1997) 547-550 |
|
Thermal expansion of periclase (MgO) and tungsten (W) |
|
to melting temperatures |
|
Sample: T = 2055 K |
|
_database_code_amcsd 0008102 |
|
3.1946 3.1946 3.1946 90 90 90 Im3m |
|
atom x y z |
|
W 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Lazor P, Saxena S K, Haggkvist P, Weber H P, |
|
Le Bihan T, Hausermann D |
| |
Physics and Chemistry of Minerals 26 (1999) 539-545 |
|
Study of laser heated iron using third generation synchrotron |
|
X-ray radiation facility with imaging plate at high pressures |
|
Sample: P = 61 GPa, T = 300 K |
|
_database_code_amcsd 0008231 |
|
3.899 3.899 3.899 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Periclase |
|
Dubrovinsky L S, Lazor P, Saxena S K, Haggkvist P, Weber H P, |
|
Le Bihan T, Hausermann D |
| |
Physics and Chemistry of Minerals 26 (1999) 539-545 |
|
Study of laser heated iron using third generation synchrotron |
|
X-ray radiation facility with imaging plate at high pressures |
|
Sample: P = 61 GPa, T = 1550 K |
|
_database_code_amcsd 0008232 |
|
3.897 3.897 3.897 90 90 90 Fm3m |
|
atom x y z |
|
Mg 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Iron |
|
Dubrovinsky L S, Lazor P, Saxena S K, Haggkvist P, Weber H P, |
|
Le Bihan T, Hausermann D |
| |
Physics and Chemistry of Minerals 26 (1999) 539-545 |
|
Study of laser heated iron using third generation synchrotron |
|
X-ray radiation facility with imaging plate at high pressures |
|
Sample: epsilon iron phase: P = 61 GPa, T = 300 K |
|
_database_code_amcsd 0008238 |
|
2.347 2.347 3.797 90 90 120 P6_3/mmc |
|
atom x y z |
|
Fe 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
|
| |
|
Iron |
|
Dubrovinsky L S, Lazor P, Saxena S K, Haggkvist P, Weber H P, |
|
Le Bihan T, Hausermann D |
| |
Physics and Chemistry of Minerals 26 (1999) 539-545 |
|
Study of laser heated iron using third generation synchrotron |
|
X-ray radiation facility with imaging plate at high pressures |
|
Sample epsilon iron phase: P = 61 GPa, T = 1550 K |
|
_database_code_amcsd 0008239 |
|
2.346 2.346 3.808 90 90 120 P6_3/mmc |
|
atom x y z |
|
Fe 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
|
| |
|
Magnetite |
|
Gatta G D, Kantor I, Ballaran T B, Dubrovinsky L, McCammon C |
| |
Physics and Chemistry of Minerals 34 (2007) 627-635 |
|
Effect of non-hydrostatic conditions on the elastic behaviour of magnetite: |
|
an in situ single-crystal X-ray diffraction study |
|
Locality: synthetic |
|
Sample: P = 0.0001 GPa, T = 293 K |
|
_database_code_amcsd 0009109 |
|
8.3950 8.3950 8.3950 90 90 90 *Fd-3m |
|
.125 .125 .125 |
|
atom x y z Uiso |
|
FeT .125 .125 .125 .0063 |
|
FeM .5 .5 .5 .0081 |
|
O .2546 .2546 .2546 .0072 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnetite |
|
Gatta G D, Kantor I, Ballaran T B, Dubrovinsky L, McCammon C |
| |
Physics and Chemistry of Minerals 34 (2007) 627-635 |
|
Effect of non-hydrostatic conditions on the elastic behaviour of magnetite: |
|
an in situ single-crystal X-ray diffraction study |
|
Locality: synthetic |
|
Sample: P = 4.99 GPa, T = 293 K |
|
_database_code_amcsd 0009110 |
|
8.3198 8.3198 8.3198 90 90 90 *Fd-3m |
|
.125 .125 .125 |
|
atom x y z Uiso |
|
FeT .125 .125 .125 .0087 |
|
FeM .5 .5 .5 .0078 |
|
O .2541 .2541 .2541 .0054 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnetite |
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Gatta G D, Kantor I, Ballaran T B, Dubrovinsky L, McCammon C |
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Physics and Chemistry of Minerals 34 (2007) 627-635 |
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Effect of non-hydrostatic conditions on the elastic behaviour of magnetite: |
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an in situ single-crystal X-ray diffraction study |
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Locality: synthetic |
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Sample: P = 9.21 GPa, T = 293 K |
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_database_code_amcsd 0009111 |
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8.2634 8.2634 8.2634 90 90 90 *Fd-3m |
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.125 .125 .125 |
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atom x y z Uiso |
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FeT .125 .125 .125 .0085 |
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FeM .5 .5 .5 .0079 |
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O .2540 .2540 .2540 .0048 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
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Boron |
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Zarechnaya E Y, Dubrovinsky L, Dubrovinskaia N, Filinchuk Y, Chernyshov D, Dmitriev V, |
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Miyajima N, El Goresy A, Braun H F, Van Smaalen S, Kantor I, Kantor A, Prakapenka V, |
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Hanfland M, Mikhaylushkin A S, Abrikosov I A, Simak S I |
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Physical Review Letters 102 (2009) 185501-1185501-4 |
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Superhard semiconducting optically transparent high pressure phase of boron |
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Note: crystal quenched from 20 GPa, 1700 K |
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Locality: synthetic |
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_database_code_amcsd 0015285 |
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5.0576 5.6245 6.9884 90 90 90 Pnnm |
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atom x y z |
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B1 .1539 .5938 .7924 |
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B2 .6469 .7284 .5 |
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B3 .3362 .5076 0 |
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B4 .8391 .7189 .8737 |
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B5 .6690 .9823 0 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
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Baddeleyite |
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Swamy V, Dubrovinsky L S, Dubrovinskaia N A, Langenhorst F, |
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Simionovici A S, Drakopoulos M, Dmitriev V, Weber H P |
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Solid State Communications 134 (2005) 541-546 |
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Size effects on the structure and phase transition behavior of baddeleyite TiO2 |
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Locality: synthetic |
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_database_code_amcsd 0015497 |
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4.589 4.849 4.736 90 98.6 90 P2_1/c |
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atom x y z |
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Ti1 .309 .045 .218 |
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O1 .056 .347 .282 |
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O2 .425 .727 .463 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
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