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Ferrocolumbite |
 |
Tarantino S C, Zema M |
 |
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n3 Qm=1 from S. Jose de Safira, Minas Gerais, Brazil |
|
_database_code_amcsd 0003826 |
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14.2877 5.7363 5.0561 90 90 90 Pbcn |
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atom x y z occ Uiso |
|
FeA 0 .32935 .25 .202 .0066 |
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MnA 0 .32935 .25 .767 .0066 |
|
TiA 0 .32935 .25 .028 .0066 |
|
ScA 0 .32935 .25 .001 .0066 |
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CaA 0 .32935 .25 .001 .0066 |
|
SnA 0 .32935 .25 .001 .0066 |
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NbB .161507 .18026 .747924 .955 .0047 |
|
TaB .161507 .18026 .747924 .040 .0047 |
|
TiB .161507 .18026 .747924 .004 .0047 |
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WB .161507 .18026 .747924 .001 .0047 |
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O1 .09697 .10323 .06932 .0069 |
|
O2 .08150 .38359 .59769 .0080 |
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O3 .24388 .12397 .41844 .0061 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: AMB n3 Qm=1 from Ambatofotsikely, Madagascar |
|
_database_code_amcsd 0003827 |
|
14.3267 5.7392 5.0674 90 90 90 Pbcn |
|
atom x y z occ Uiso |
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FeA 0 .32531 .25 .462 .0081 |
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MnA 0 .32531 .25 .476 .0081 |
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ScA 0 .32531 .25 .045 .0081 |
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TiA 0 .32531 .25 .012 .0081 |
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SnA 0 .32531 .25 .004 .0081 |
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CaA 0 .32531 .25 .001 .0081 |
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NbB .162115 .17965 .74368 .903 .0060 |
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TaB .162115 .17965 .74368 .043 .0060 |
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TiB .162115 .17965 .74368 .052 .0060 |
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WB .162115 .17965 .74368 .002 .0060 |
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O1 .09742 .1025 .0641 .0068 |
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O2 .08143 .3835 .5974 .0087 |
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O3 .24383 .1239 .4138 .0069 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n18 Qm=0.618 from S. Jose de Safira, Minas Gerais, Brazil |
|
Note: Occupancies calculated assuming complete Fe/Mn disorder |
|
_database_code_amcsd 0003830 |
|
14.2427 5.7290 5.0856 90 90 90 Pbcn |
|
atom x y z occ Uiso |
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FeA 0 .33008 .25 .589 .0077 |
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NbA 0 .33008 .25 .250 .0077 |
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MnA 0 .33008 .25 .156 .0077 |
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TaA 0 .33008 .25 .005 .0077 |
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NbB .162922 .17652 .74777 .825 .0066 |
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FeB .162922 .17652 .74777 .100 .0066 |
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TaB .162922 .17652 .74777 .048 .0066 |
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MnB .162922 .17652 .74777 .027 .0066 |
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O1 .09492 .1065 .0718 .0091 |
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O2 .42004 .1170 .0936 .0100 |
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O3 .75627 .1218 .0823 .0082 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n18 Qm=0.685 from S. Jose de Safira, Minas Gerais, Brazil |
|
Sample: Annealed at T = 600 C for t = 20 m |
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Note: Occupancies calculated assuming complete Fe/Mn disorder |
|
_database_code_amcsd 0003831 |
|
14.2445 5.7265 5.0789 90 90 90 Pbcn |
|
atom x y z occ Uiso |
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FeA 0 .32929 .25 .625 .0074 |
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NbA 0 .32929 .25 .207 .0074 |
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MnA 0 .32929 .25 .165 .0074 |
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TaA 0 .32929 .25 .003 .0074 |
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NbB .162846 .17715 .74782 .846 .0062 |
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FeB .162846 .17715 .74782 .083 .0062 |
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TaB .162846 .17715 .74782 .049 .0062 |
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MnB .162846 .17715 .74782 .022 .0062 |
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O1 .09502 .10630 .0721 .0088 |
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O2 .41991 .11684 .0944 .0094 |
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O3 .75624 .12194 .0828 .0080 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n18 Qm=0.714 from S. Jose de Safira, Minas Gerais, Brazil |
|
Sample: Annealed at T = 650 C for t = 20 m |
|
Note: Occupancies calculated assuming complete Fe/Mn disorder |
|
_database_code_amcsd 0003832 |
|
14.2501 5.7263 5.0767 90 90 90 Pbcn |
|
atom x y z occ Uiso |
|
FeA 0 .32898 .25 .640 .0069 |
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NbA 0 .32898 .25 .188 .0069 |
|
MnA 0 .32898 .25 .169 .0069 |
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TaA 0 .32898 .25 .003 .0069 |
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NbB .162739 .17765 .74783 .856 .0057 |
|
FeB .162739 .17765 .74783 .075 .0057 |
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TaB .162739 .17765 .74783 .049 .0057 |
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MnB .162739 .17765 .74783 .020 .0057 |
|
O1 .09526 .10613 .0714 .0085 |
|
O2 .41987 .11665 .0942 .0093 |
|
O3 .75626 .12201 .0822 .0078 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n18 Qm=0.745 from S. Jose de Safira, Minas Gerais, Brazil |
|
Sample: Annealed at T = 650 C for t = 200 m |
|
Note: Occupancies calculated assuming complete Fe/Mn disorder |
|
_database_code_amcsd 0003833 |
|
14.2582 5.7290 5.0748 90 90 90 Pbcn |
|
atom x y z occ Uiso |
|
FeA 0 .32890 .25 .657 .0068 |
|
MnA 0 .32890 .25 .173 .0068 |
|
NbA 0 .32890 .25 .168 .0068 |
|
TaA 0 .32890 .25 .002 .0068 |
|
NbB .162585 .17803 .74783 .866 .0056 |
|
FeB .162585 .17803 .74783 .067 .0056 |
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TaB .162585 .17803 .74783 .049 .0056 |
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MnB .162585 .17803 .74783 .018 .0056 |
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O1 .09542 .10587 .0713 .0082 |
|
O2 .41968 .11675 .0947 .0090 |
|
O3 .75611 .12241 .0822 .0074 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n18 Qm=0.752 from S. Jose de Safira, Minas Gerais, Brazil |
|
Sample: Annealed at T = 700 C for t = 5 m |
|
Note: Occupancies calculated assuming complete Fe/Mn disorder |
|
_database_code_amcsd 0003834 |
|
14.2600 5.7293 5.0746 90 90 90 Pbcn |
|
atom x y z occ Uiso |
|
FeA 0 .32897 .25 .660 .0067 |
|
MnA 0 .32897 .25 .175 .0067 |
|
NbA 0 .32897 .25 .164 .0067 |
|
TaA 0 .32897 .25 .001 .0067 |
|
NbB .162566 .17806 .74780 .868 .0056 |
|
FeB .162566 .17806 .74780 .066 .0056 |
|
TaB .162566 .17806 .74780 .050 .0056 |
|
MnB .162566 .17806 .74780 .017 .0056 |
|
O1 .09540 .10591 .0712 .0082 |
|
O2 .41965 .11679 .0949 .0093 |
|
O3 .75624 .12256 .0824 .0076 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n18 Qm=0.759 from S. Jose de Safira, Minas Gerais, Brazil |
|
Sample: Annealed at T = 700 C for t = 20 m |
|
Note: Occupancies calculated assuming complete Fe/Mn disorder |
|
_database_code_amcsd 0003835 |
|
14.2658 5.7299 5.0748 90 90 90 Pbcn |
|
atom x y z occ Uiso |
|
FeA 0 .32883 .25 .664 .0065 |
|
MnA 0 .32883 .25 .175 .0065 |
|
NbA 0 .32883 .25 .161 .0065 |
|
NbB .162499 .178229 .74783 .870 .0052 |
|
FeB .162499 .178229 .74783 .063 .0052 |
|
TaB .162499 .178229 .74783 .050 .0052 |
|
MnB .162499 .178229 .74783 .017 .0052 |
|
O1 .09553 .10546 .0708 .0079 |
|
O2 .41954 .11696 .0949 .0088 |
|
O3 .75613 .12263 .0820 .0074 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n18 Qm=0.898 from S. Jose de Safira, Minas Gerais, Brazil |
|
Sample: Annealed at T = 800 C for t = 7 m |
|
Note: Occupancies calculated assuming complete Fe/Mn disorder |
|
_database_code_amcsd 0003836 |
|
14.2733 5.7317 5.0646 90 90 90 Pbcn |
|
atom x y z occ Uiso |
|
FeA 0 .32901 .25 .737 .0059 |
|
MnA 0 .32901 .25 .195 .0059 |
|
NbA 0 .32901 .25 .068 .0059 |
|
NbB .161976 .17932 .747813 .916 .0045 |
|
TaB .161976 .17932 .747813 .050 .0045 |
|
FeB .161976 .17932 .747813 .027 .0045 |
|
MnB .161976 .17932 .747813 .007 .0045 |
|
O1 .09620 .10423 .0702 .0070 |
|
O2 .41902 .11657 .0966 .0081 |
|
O3 .75607 .12332 .0820 .0066 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n18 Qm=0.902 from S. Jose de Safira, Minas Gerais, Brazil |
|
Sample: Annealed at T = 800 C for t = 40 m |
|
Note: Occupancies calculated assuming complete Fe/Mn disorder |
|
_database_code_amcsd 0003837 |
|
14.2744 5.7321 5.0616 90 90 90 Pbcn |
|
atom x y z occ Uiso |
|
FeA 0 .32897 .25 .739 .0061 |
|
MnA 0 .32897 .25 .195 .0061 |
|
NbA 0 .32897 .25 .066 .0061 |
|
NbB .161958 .17943 .74774 .917 .0047 |
|
TaB .161958 .17943 .74774 .050 .0047 |
|
FeB .161958 .17943 .74774 .026 .0047 |
|
MnB .161958 .17943 .74774 .007 .0047 |
|
O1 .09645 .10415 .0700 .0070 |
|
O2 .41903 .11675 .0964 .0084 |
|
O3 .75604 .12375 .0821 .0066 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M |
|
American Mineralogist 90 (2005) 1291-1300 |
|
Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: |
|
A single-crystal X-ray diffraction study |
|
Sample: BRA n18 Qm=0.988 from S. Jose de Safira, Minas Gerais, Brazil |
|
Sample: Annealed at T = 950 C for t = 3 h |
|
Note: Occupancies calculated assuming complete Fe/Mn disorder |
|
_database_code_amcsd 0003838 |
|
14.2852 5.7361 5.0574 90 90 90 Pbcn |
|
atom x y z occ Uiso |
|
FeA 0 .32904 .25 .785 .0059 |
|
MnA 0 .32904 .25 .207 .0059 |
|
NbA 0 .32904 .25 .008 .0059 |
|
NbB .161550 .18024 .747862 .945 .0041 |
|
TaB .161550 .18024 .747862 .051 .0041 |
|
FeB .161550 .18024 .747862 .003 .0041 |
|
MnB .161550 .18024 .747862 .001 .0041 |
|
O1 .09692 .10376 .0692 .0059 |
|
O2 .41864 .11713 .0977 .0077 |
|
O3 .75587 .12388 .0814 .0061 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M, Pistorino M, Domeneghetti M C |
| |
Physics and Chemistry of Minerals 30 (2003) 590-598 |
|
High-temperature X-ray investigation of natural columbites |
|
Note: sample BRA3 at T = 20 C |
|
Locality: San Jose de Safira, Minas Gerais, Brazil |
|
_database_code_amcsd 0008836 |
|
14.2880 5.7364 5.0562 90 90 90 Pbcn |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Fe2+A 0 .3289 .25 .747 .0069 .0061 .0071 .0075 0 -.0002 0 |
|
Mn2+A 0 .3289 .25 .215 .0069 .0061 .0071 .0075 0 -.0002 0 |
|
Ti4+A 0 .3289 .25 .027 .0069 .0061 .0071 .0075 0 -.0002 0 |
|
Nb5+B .1617 .1802 .7479 .947 .0055 .0049 .0052 .0063 .0003 -.0003 -.0001 |
|
Ta5+B .1617 .1802 .7479 .047 .0055 .0049 .0052 .0063 .0003 -.0003 -.0001 |
|
W6+B .1617 .1802 .7479 .0015 .0055 .0049 .0052 .0063 .0003 -.0003 -.0001 |
|
Sc3+B .1617 .1802 .7479 .0015 .0055 .0049 .0052 .0063 .0003 -.0003 -.0001 |
|
Ca2+B .1617 .1802 .7479 .0005 .0055 .0049 .0052 .0063 .0003 -.0003 -.0001 |
|
Sn4+B .1617 .1802 .7479 .0005 .0055 .0049 .0052 .0063 .0003 -.0003 -.0001 |
|
O1 .0971 .1034 .0692 .0075 .0081 .0057 .0088 .0012 -.0003 .0012 |
|
O2 .0815 .3827 .5975 .0092 .0085 .0077 .0114 .0013 -.0003 -.0002 |
|
O3 .2443 .1238 .4186 .0079 .0084 .0072 .0081 -.0014 -.0003 -.0009 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M, Pistorino M, Domeneghetti M C |
| |
Physics and Chemistry of Minerals 30 (2003) 590-598 |
|
High-temperature X-ray investigation of natural columbites |
|
Note: sample BRA3 at T = 300 C |
|
Locality: San Jose de Safira, Minas Gerais, Brazil |
|
_database_code_amcsd 0008837 |
|
14.3191 5.7482 5.0713 90 90 90 Pbcn |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Fe2+A 0 .3283 .25 .747 .0213 .0195 .0160 .0284 0 -.0005 0 |
|
Mn2+A 0 .3283 .25 .215 .0213 .0195 .0160 .0284 0 -.0005 0 |
|
Ti4+A 0 .3283 .25 .027 .0213 .0195 .0160 .0284 0 -.0005 0 |
|
Nb5+B .1617 .1797 .7456 .947 .0170 .0169 .0125 .0216 -.0001 -.0002 -.0001 |
|
Ta5+B .1617 .1797 .7456 .047 .0170 .0169 .0125 .0216 -.0001 -.0002 -.0001 |
|
W6+B .1617 .1797 .7456 .0015 .0170 .0169 .0125 .0216 -.0001 -.0002 -.0001 |
|
Sc3+B .1617 .1797 .7456 .0015 .0170 .0169 .0125 .0216 -.0001 -.0002 -.0001 |
|
Ca2+B .1617 .1797 .7456 .0005 .0170 .0169 .0125 .0216 -.0001 -.0002 -.0001 |
|
Sn4+B .1617 .1797 .7456 .0005 .0170 .0169 .0125 .0216 -.0001 -.0002 -.0001 |
|
O1 .0968 .1029 .0675 .0217 .0213 .0194 .0243 -.0031 .0003 .0028 |
|
O2 .0819 .3828 .5972 .0226 .0239 .0212 .0228 .0004 .0008 -.0006 |
|
O3 .2444 .1248 .4163 .0217 .0242 .0171 .0238 -.0014 .0017 .0018 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Ferrocolumbite |
|
Tarantino S C, Zema M, Pistorino M, Domeneghetti M C |
| |
Physics and Chemistry of Minerals 30 (2003) 590-598 |
|
High-temperature X-ray investigation of natural columbites |
|
Note: sample BRA3 at T = 600 C |
|
Locality: San Jose de Safira, Minas Gerais, Brazil |
|
_database_code_amcsd 0008838 |
|
14.3515 5.7610 5.0833 90 90 90 Pbcn |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Fe2+A 0 .3272 .25 .747 .0299 .0257 .0270 .0369 0 .0004 0 |
|
Mn2+A 0 .3272 .25 .215 .0299 .0257 .0270 .0369 0 .0004 0 |
|
Ti4+A 0 .3272 .25 .027 .0299 .0257 .0270 .0369 0 .0004 0 |
|
Nb5+B .1617 .1799 .7440 .947 .0225 .0202 .0183 .0290 .0002 -.0006 -.0002 |
|
Ta5+B .1617 .1799 .7440 .047 .0225 .0202 .0183 .0290 .0002 -.0006 -.0002 |
|
W6+B .1617 .1799 .7440 .0015 .0225 .0202 .0183 .0290 .0002 -.0006 -.0002 |
|
Sc3+B .1617 .1799 .7440 .0015 .0225 .0202 .0183 .0290 .0002 -.0006 -.0002 |
|
Ca2+B .1617 .1799 .7440 .0005 .0225 .0202 .0183 .0290 .0002 -.0006 -.0002 |
|
Sn4+B .1617 .1799 .7440 .0005 .0225 .0202 .0183 .0290 .0002 -.0006 -.0002 |
|
O1 .0970 .1029 .0631 .0251 .0241 .0191 .0321 .0033 .0019 .0016 |
|
O2 .0816 .3819 .5941 .0314 .0287 .0285 .0371 .0056 -.0043 -.0006 |
|
O3 .2442 .1250 .4167 .0267 .0231 .0233 .0336 -.0027 .0015 .0021 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
Multiple datasets can be concatenated into a single downloadable file by selecting the datasets and then clicking
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Total number of retrieved datasets: 