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12 matching records for this search.

Tausonite

Yamanaka T, Hirai M, Komatsu Y

American Mineralogist 87 (2002) 1183-1189

Structure change of Ca1-xSrxTiO3 perovskite with composition and pressure

Sample: Ca.4Sr.6TiO3, x = 0.6

_database_code_amcsd 0002893

5.4784 5.4791 7.7517 90 90 90 Pbnm

atom x y z occ Biso

Ca .9975 .0053 .25 .4 .74

Sr .9975 .0053 .25 .6 .74

Ti .5 0 0 .82

O1 .005 .496 .25 1.5

O2 .739 .262 .022 1.6

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View JMOL 3-D Structure (permalink)

Tausonite

Yamanaka T, Hirai M, Komatsu Y

American Mineralogist 87 (2002) 1183-1189

Structure change of Ca1-xSrxTiO3 perovskite with composition and pressure

Sample: Ca.35Sr.65TiO3, x = 0.65

_database_code_amcsd 0002894

5.4801 5.4801 7.7619 90 90 90 I4/mcm

atom x y z occ Biso

Ca 0 .5 .25 .35 .65

Sr 0 .5 .25 .65 .65

Ti 0 0 0 .66

O1 0 0 .25 1.6

O2 .776 .276 0 1.7

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View JMOL 3-D Structure (permalink)

Tausonite

Yamanaka T, Hirai M, Komatsu Y

American Mineralogist 87 (2002) 1183-1189

Structure change of Ca1-xSrxTiO3 perovskite with composition and pressure

Sample: SrTiO3, x = 1.0

_database_code_amcsd 0002895

5.5202 5.5202 7.8067 90 90 90 Pbnm

atom x y z Biso

Sr 0 0 .25 .48

Ti .5 0 0 .40

O1 0 .5 .25 1.3

O2 .75 .25 0 1.6

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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)

Tausonite

Yamanaka T, Hirai M, Komatsu Y

American Mineralogist 87 (2002) 1183-1189

Structure change of Ca1-xSrxTiO3 perovskite with composition and pressure

Sample: P = 4.1 GPa, Ca.35Sr.65TiO3

_database_code_amcsd 0002896

5.423 5.420 7.647 90 90 90 Pbnm

atom x y z occ Biso

Ca .969 .024 .25 .35 .76

Sr .969 .024 .25 .65 .76

Ti 0 .5 0 .62

O1 .035 .527 .25 1.43

O2 .765 .243 .011 1.32

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View JMOL 3-D Structure (permalink)

Tausonite

Yamanaka T, Hirai M, Komatsu Y

American Mineralogist 87 (2002) 1183-1189

Structure change of Ca1-xSrxTiO3 perovskite with composition and pressure

Sample: P = 7.0 GPa, Ca.35Sr.65TiO3

_database_code_amcsd 0002897

5.415 5.412 7.637 90 90 90 Pbnm

atom x y z occ Biso

Ca .988 .012 .25 .35 .22

Sr .988 .012 .25 .65 .22

Ti 0 .5 0 .51

O1 .036 .543 .25 2.20

O2 .768 .233 .010 .75

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View JMOL 3-D Structure (permalink)

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

Sample: synchrotron XRD data

_database_code_amcsd 0008445

5.49755 5.49755 7.78810 90 90 90 I4/mcm

atom x y z occ Biso

SrA 0 .5 .25 .5 .28

NaA 0 .5 .25 .25 .28

LaA 0 .5 .25 .25 .28

Ti 0 0 0 .22

O1 0 0 .25 .26

O2 .2248 .7248 0 .26

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View JMOL 3-D Structure (permalink)

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

Sample: x = 0.00

_database_code_amcsd 0008446

3.90528 3.90528 3.90528 90 90 90 Pm-3m

atom x y z

SrA .5 .5 .5

Ti 0 0 0

O .5 0 0

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View JMOL 3-D Structure (permalink)

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

Sample: x = 0.05

_database_code_amcsd 0008447

3.90427 3.90427 3.90427 90 90 90 Pm-3m

atom x y z occ

SrA .5 .5 .5 .90

NaA .5 .5 .5 .05

LaA .5 .5 .5 .05

Ti 0 0 0

O .5 0 0

Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)

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

Sample: x = 0.10

_database_code_amcsd 0008448

3.90170 3.90170 3.90170 90 90 90 Pm-3m

atom x y z occ

SrA .5 .5 .5 .80

NaA .5 .5 .5 .10

LaA .5 .5 .5 .10

Ti 0 0 0

O .5 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 (permalink)

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

Sample: x = 0.15

_database_code_amcsd 0008449

5.5116 5.5116 7.8036 90 90 90 I4/mcm

atom x y z occ

SrA 0 .5 .25 .70

NaA 0 .5 .25 .15

LaA 0 .5 .25 .15

Ti 0 0 0

O1 0 0 .25

O2 .239 .739 0

Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)

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

Sample: x = 0.20

_database_code_amcsd 0008450

5.5073 5.5073 7.8018 90 90 90 I4/mcm

atom x y z occ

SrA 0 .5 .25 .60

NaA 0 .5 .25 .20

LaA 0 .5 .25 .20

Ti 0 0 0

O1 0 0 .25

O2 .235 .735 0

Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)

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

Sample: x = 0.25

_database_code_amcsd 0008451

5.5016 5.5016 7.7976 90 90 90 I4/mcm

atom x y z occ Biso

SrA 0 .5 .25 .5 .93

NaA 0 .5 .25 .25 .93

LaA 0 .5 .25 .25 .93

Ti 0 0 0 .84

O1 0 0 .25 2.2

O2 .233 .733 0 .6

Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)

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Total number of retrieved datasets: 12
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