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Tausonite |
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Mitchell R H, Chakhmouradian A R, Woodward P M |
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Physics and Chemistry of Minerals 27 (2000) 583-589 |
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Crystal chemistry of perovskite-type compounds in the |
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tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: synchrotron XRD data |
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_database_code_amcsd 0008445 |
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5.49755 5.49755 7.78810 90 90 90 I4/mcm |
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atom x y z occ Biso |
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SrA 0 .5 .25 .5 .28 |
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NaA 0 .5 .25 .25 .28 |
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LaA 0 .5 .25 .25 .28 |
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Ti 0 0 0 .22 |
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O1 0 0 .25 .26 |
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O2 .2248 .7248 0 .26 |
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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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Tausonite |
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Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
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tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.00 |
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_database_code_amcsd 0008446 |
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3.90528 3.90528 3.90528 90 90 90 Pm-3m |
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atom x y z |
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SrA .5 .5 .5 |
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Ti 0 0 0 |
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O .5 0 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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Tausonite |
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Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
|
tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.05 |
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_database_code_amcsd 0008447 |
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3.90427 3.90427 3.90427 90 90 90 Pm-3m |
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atom x y z occ |
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SrA .5 .5 .5 .90 |
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NaA .5 .5 .5 .05 |
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LaA .5 .5 .5 .05 |
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Ti 0 0 0 |
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O .5 0 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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Tausonite |
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Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
|
tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.10 |
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_database_code_amcsd 0008448 |
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3.90170 3.90170 3.90170 90 90 90 Pm-3m |
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atom x y z occ |
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SrA .5 .5 .5 .80 |
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NaA .5 .5 .5 .10 |
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LaA .5 .5 .5 .10 |
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Ti 0 0 0 |
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O .5 0 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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Tausonite |
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Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
|
tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.15 |
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_database_code_amcsd 0008449 |
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5.5116 5.5116 7.8036 90 90 90 I4/mcm |
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atom x y z occ |
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SrA 0 .5 .25 .70 |
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NaA 0 .5 .25 .15 |
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LaA 0 .5 .25 .15 |
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Ti 0 0 0 |
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O1 0 0 .25 |
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O2 .239 .739 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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Tausonite |
|
Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
|
tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.20 |
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_database_code_amcsd 0008450 |
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5.5073 5.5073 7.8018 90 90 90 I4/mcm |
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atom x y z occ |
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SrA 0 .5 .25 .60 |
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NaA 0 .5 .25 .20 |
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LaA 0 .5 .25 .20 |
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Ti 0 0 0 |
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O1 0 0 .25 |
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O2 .235 .735 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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Tausonite |
|
Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
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tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.25 |
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_database_code_amcsd 0008451 |
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5.5016 5.5016 7.7976 90 90 90 I4/mcm |
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atom x y z occ Biso |
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SrA 0 .5 .25 .5 .93 |
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NaA 0 .5 .25 .25 .93 |
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LaA 0 .5 .25 .25 .93 |
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Ti 0 0 0 .84 |
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O1 0 0 .25 2.2 |
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O2 .233 .733 0 .6 |
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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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Loparite |
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Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
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Crystal chemistry of perovskite-type compounds in the |
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tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.30 |
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_database_code_amcsd 0008452 |
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5.5025 5.5025 7.7701 90 90 90 I4/mcm |
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atom x y z occ |
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SrA 0 .5 .25 .40 |
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NaA 0 .5 .25 .30 |
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LaA 0 .5 .25 .30 |
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Ti 0 0 0 |
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O1 0 0 .25 |
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O2 .229 .729 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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Loparite |
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Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
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tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.35 |
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_database_code_amcsd 0008453 |
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5.4912 5.4912 7.7839 90 90 90 I4/mcm |
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atom x y z occ |
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SrA 0 .5 .25 .30 |
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NaA 0 .5 .25 .35 |
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LaA 0 .5 .25 .35 |
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Ti 0 0 0 |
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O1 0 0 .25 |
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O2 .226 .726 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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Loparite |
| |
Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
|
tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.40 |
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_database_code_amcsd 0008454 |
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5.4882 5.4882 13.442 90 90 120 R-3c |
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atom x y z occ Biso |
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SrA 0 0 .25 .20 .89 |
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NaA 0 0 .25 .40 .89 |
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LaA 0 0 .25 .40 .89 |
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Ti 0 0 0 1.0 |
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O .533 0 .25 1.3 |
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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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Loparite |
| |
Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
|
tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
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Sample: x = 0.45 |
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_database_code_amcsd 0008455 |
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5.4855 5.4855 13.440 90 90 120 R-3c |
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atom x y z occ |
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SrA 0 0 .25 .10 |
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NaA 0 0 .25 .45 |
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LaA 0 0 .25 .45 |
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Ti 0 0 0 |
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O .535 0 .25 |
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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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Loparite |
| |
Mitchell R H, Chakhmouradian A R, Woodward P M |
| |
Physics and Chemistry of Minerals 27 (2000) 583-589 |
|
Crystal chemistry of perovskite-type compounds in the |
|
tausonite-loparite series, (Sr1-2xNaxLax)TiO3 |
|
Sample: x = 0.50 |
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_database_code_amcsd 0008456 |
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5.4820 5.4820 13.4104 90 90 120 R-3c |
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atom x y z occ |
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NaA 0 0 .25 .50 |
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LaA 0 0 .25 .50 |
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Ti 0 0 0 |
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O .539 0 .25 |
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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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Bi2O4 |
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Kumada N, Kinomura N, Woodward P M, Sleight A W |
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Journal of Solid State Chemistry 116 (1995) 281-285 |
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Crystal structure of Bi2O4 with beta-Sb2O4-type structure |
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_database_code_amcsd 0013863 |
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12.3668 5.1180 5.5670 90 107.838 90 C2/c |
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atom x y z Biso |
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Bi5+ .25 .25 0 .6 |
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Bi3+ 0 .268 .25 1.2 |
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O1 .1787 .063 .652 1.5 |
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O2 .0933 .416 .973 1.3 |
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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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