LMucko/crystallography-open-database · Datasets at Hugging Face

1,004,030

9.976

0.004

10.359

0.006

12.98

0.01

90

null

90

null

90

null

1,341.4

1.4

293

2

293

2

null

?

6

P 21 21 21

P 2ac 2ab

19

- C5 H17 N O10 P2 Zn -

- C20 H68 N4 O40 P8 Zn4 -

4

1

Simon, A.; Josien, L.; Gramlich, V.; Patarin, J.

Synthesis and characterization of Mu-19, a new zincophosphate with a three dimensional 12-membered ring channel system

Microporous and Mesoporous Materials

2,001

47

2-3

135

146

10.1016/S1387-1811(01)00312-2

0.71073

MoKα

0.0233

0.0222

null

0.0572

0.0569

null

1.126

1.159

null

has coordinates

Simon, A.; Josien, L.; Gramlich, V.; Patarin, J. Synthesis and characterization of Mu-19, a new zincophosphate with a three dimensional 12-membered ring channel system Microporous and Mesoporous Materials 47(2-3) (2001) 135-146

176,428

2020-10-21

18:00:00

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1,004,031

13.917

0.013

9.091

0.014

20.489

0.019

90

null

102.36

0.08

90

null

2,532.2

5.1

293

2

293

2

null

?

6

C 1 2/c 1

-C 2yc

15

- C5 H18 N2 O9 P2 Zn -

- C40 H144 N16 O72 P16 Zn8 -

8

1

Fleith, S.; Josien, L.; Simon-Masseron, A.; Gramlich, V.; Patarin, J.

Synthesis and characterization of the one-dimensional zincophosphate Mu-22 : [Zn(HPO4)2]8[C5H13N2]88H2O

Solid State Sciences

2,002

4

1

135

141

10.1016/S1293-2558(01)01222-5

0.71073

MoKα

0.0304

0.0268

null

0.0751

0.074

null

0.853

0.921

null

has coordinates

Fleith, S.; Josien, L.; Simon-Masseron, A.; Gramlich, V.; Patarin, J. Synthesis and characterization of the one-dimensional zincophosphate Mu-22 : [Zn(HPO4)2]8[C5H13N2]88H2O Solid State Sciences 4(1) (2002) 135-141

176,428

2020-10-21

18:00:00

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1,004,032

8.735

0.011

8.864

0.005

12.636

0.01

98.36

0.05

100.18

0.08

115.84

0.07

838.9

1.3

293

2

293

2

null

7

P -1

-P 1

2

- C12 H43 F6 Ga5 N4 O22 P4 -

1

0.5

Josien, L.; Simon, A.; Gramlich, V.; Patarin, J.

Hydrothermal synthesis and characterization of the new layered fluorogallophosphate Mu-23

Chemistry - A European Journal

2,002

8

7

1614

1620

10.1002/1521-3765(20020402)8:7<1614::AID-CHEM1614>3.0.CO;2-T

0.71073

MoKα

0.0304

0.0255

null

0.0652

0.0641

null

0.957

1.05

null

has coordinates

Josien, L.; Simon, A.; Gramlich, V.; Patarin, J. Hydrothermal synthesis and characterization of the new layered fluorogallophosphate Mu-23 Chemistry - A European Journal 8(7) (2002) 1614-1620

176,729

2020-10-21

18:00:00

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7,205,933

17.2111

0.00016

6.750071

0.000064

13.23655

0.00012

90

null

108.518

0.00064

90

null

1,458.15

0.02

298

null

298

null

5

P 1 a 1

P -2ya

7

- C4 H56 B8 Li4 N12 -

- C8 H112 B16 Li8 N24 -

2

1

Guo, Yanhui; Gu, Qinfen; Guo, Zaiping; Mao, Jianfeng; Liu, Huakun; Dou, Shixue; Yu, Xuebin

A GBH/LiBH4 coordination system with favorable dehydrogenation

Journal of Materials Chemistry

2,011

21

20

7138

10.1039/c0jm04485g

powder diffraction

1.30419

synchrotron

0.026

null

1.948

null

has coordinates

Guo, Yanhui; Gu, Qinfen; Guo, Zaiping; Mao, Jianfeng; Liu, Huakun; Dou, Shixue; Yu, Xuebin A GBH/LiBH4 coordination system with favorable dehydrogenation Journal of Materials Chemistry 21(20) (2011) 7138

180,390

2020-10-21

18:00:00

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1,004,033

8.641

0.005

14.364

0.009

12.581

0.011

90

null

96.39

0.06

90

null

1,551.8

1.9

293

2

293

2

null

?

6

P 1 21/n 1

-P 2yn

14

- C6 H18 N2 O12 P3 Zn2 -

- C24 H72 N8 O48 P12 Zn8 -

4

1

Josien, L.; Simon-Masseron, A.; Fleith, S.; Gramlich, V.; Patarin, J.

Hydrothermal synthesis and characterization of new phosphate-based materials prepared in the presence of 1,4-dimethylpiperazine

Impact of Zeolites and other Porous Materials on the new Technologies at the Beginning of the New Millennium Proceedings of the 2nd International FEZA (Federation of the European Zeolite Associations) Conference

2,002

142

415

422

10.1016/S0167-2991(02)80056-8

0.71073

MoKα

0.044

0.0307

null

0.0732

0.072

null

0.836

1.011

null

has coordinates

Josien, L.; Simon-Masseron, A.; Fleith, S.; Gramlich, V.; Patarin, J. Hydrothermal synthesis and characterization of new phosphate-based materials prepared in the presence of 1,4-dimethylpiperazine Impact of Zeolites and other Porous Materials on the new Technologies at the Beginning of the New Millennium Proceedings o...

176,729

2020-10-21

18:00:00

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1,004,034

13.905

null

9.952

null

7.185

null

90

null

90

null

90

null

994.3

null

5

P n m a

-P 2ac 2n

62

Potassium pentachloroaquaindate

- Cl5 H2 In K2 O -

- Cl20 H8 In4 K8 O4 -

4

0.5

Wignacourt, J P; Mairesse, G; Barbier, P

Potassium pentachloroindate monohydrate, K~2~ (In Cl~5~, H~2~ O)

Crystal Structure Communications

1,976

5

293

296

null

0.071

null

has coordinates

Wignacourt, J P; Mairesse, G; Barbier, P Potassium pentachloroindate monohydrate, K~2~ (In Cl~5~, H~2~ O) Crystal Structure Communications 5 (1976) 293-296

200,452

2020-10-21

18:00:00

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1,004,035

10.023

null

10.023

null

25.471

null

90

null

90

null

120

null

2,216

null

4

R -3 c :H

-R 3 2"c

167

Barium dihydroxotrioxoruthenate(VI)

- Ba H2 O5 Ru -

- Ba18 H36 O90 Ru18 -

18

0.5

Nowogrocki, G.; Abraham, F.; Trehoux, J.; Thomas, D.

Configuration de l'ion ruthenate: structure cristalline du dihydroxotrioxoruthenate(VI) de baryum, Ba (Ru O~3~ (O H)~2~)

Acta Crystallographica B (24,1968-38,1982)

1,976

32

2413

2419

10.1107/S0567740876007875

null

0.023

null

has coordinates

Nowogrocki, G.; Abraham, F.; Trehoux, J.; Thomas, D. Configuration de l'ion ruthenate: structure cristalline du dihydroxotrioxoruthenate(VI) de baryum, Ba (Ru O~3~ (O H)~2~) Acta Crystallographica B (24,1968-38,1982) 32 (1976) 2413-2419

191,024

2020-10-21

18:00:00

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1,004,036

7.007

0.003

6.504

0.004

12.995

0.01

90

null

93.32

0.05

90

null

591.2

null

3

P 1 21/c 1

-P 2ybc

14

LITHIUM TETRACHLOROALUMINATE

- Al Cl4 Li -

- Al4 Cl16 Li4 -

4

1

Mairesse, G; Barbier, P; Vignacourt, J P

Lithium tetrachloroaluminate, Li Al Cl~4~

Crystal Structure Communications

1,977

6

15

18

null

0.029

null

has coordinates

Mairesse, G; Barbier, P; Vignacourt, J P Lithium tetrachloroaluminate, Li Al Cl~4~ Crystal Structure Communications 6 (1977) 15-18

130,149

2020-10-21

18:00:00

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7,205,932

8.7695

0.0006

13.3414

0.0011

15.9829

0.0011

77.119

0.008

89.166

0.006

71.187

0.006

1,722.2

0.2

173

2

173

2

null

3

P -1

-P 1

2

- C47 H29 Cl3 -

- C94 H58 Cl6 -

2

1

Zhao, Zujin; Chen, Shuming; Lam, Jacky W. Y.; Wang, Zhiming; Lu, Ping; Mahtab, Faisal; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Kwok, Hoi Sing; Tang, Ben Zhong

Pyrene-substituted ethenes: aggregation-enhanced excimer emission and highly efficient electroluminescence

Journal of Materials Chemistry

2,011

21

20

7210

10.1039/c0jm04449k

1.54178

CuKα

0.0875

0.0747

null

0.197

0.2066

null

1.076

null

has coordinates

Zhao, Zujin; Chen, Shuming; Lam, Jacky W. Y.; Wang, Zhiming; Lu, Ping; Mahtab, Faisal; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Kwok, Hoi Sing; Tang, Ben Zhong Pyrene-substituted ethenes: aggregation-enhanced excimer emission and highly efficient electroluminescence Journal of Materials Chemistry 21(20) (2011...

301,863

2025-08-22

13:07:26

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1,004,037

10.965

0.001

10.965

0.001

10.965

0.001

90

null

90

null

90

null

1,318.3

null

4

F d -3 m :2

-F 4vw 2vw 3

227

Potassium bismuth oxide hydroxide *

- Bi2.37 H1.9 K1.14 O6.8 -

- Bi2.37 H3.7998 K1.14 O6.8 -

- Bi18.96 H30.3984 K9.12 O54.4 -

8

0.041667

Trehoux, J; Abraham, F; Thomas, D

Etude structurale d'un pyrochlore non stoechiometrique et desordonne contenant Bi(III) et Bi(V)

Journal of Solid State Chemistry

1,977

21

203

209

10.1016/0022-4596(77)90197-9

null

0.037

null

has coordinates

Trehoux, J; Abraham, F; Thomas, D Etude structurale d'un pyrochlore non stoechiometrique et desordonne contenant Bi(III) et Bi(V) Journal of Solid State Chemistry 21 (1977) 203-209

176,435

2020-10-21

18:00:00

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1,004,038

10.481

0.009

7.183

0.005

9.273

0.005

93.1

0.03

90

null

90

null

697.1

null

3

P 21 1 1

P 2xa

4

Potassium tetrachloroaluminate

- Al Cl4 K -

- Al4 Cl16 K4 -

4

2

Mairesse, G; Barbier, P; Wignacourt, J P

Potassium tetrachloroaluminate

Acta Crystallographica B (24,1968-38,1982)

1,978

34

1328

1330

10.1107/S0567740878005464

null

0.035

null

has coordinates

Mairesse, G; Barbier, P; Wignacourt, J P Potassium tetrachloroaluminate Acta Crystallographica B (24,1968-38,1982) 34 (1978) 1328-1330

130,149

2020-10-21

18:00:00

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1,004,039

10.513

0.009

10.838

0.007

10.965

0.011

99.21

0.03

135.48

0.03

97.15

0.03

811.7

null

5

P 1

1

Potassium tetrakis(chlorosulfato)borate

- B Cl4 K O12 S4 -

- B2 Cl8 K2 O24 S8 -

2

Mairesse, G; Drache, M

The crystal structure of potassium tetrachlorosulfatoborate, K (B (S O~3~ Cl)~4~)

Acta Crystallographica B (24,1968-38,1982)

1,978

34

1771

1776

10.1107/S0567740878006676

null

0.035

null

has coordinates

Mairesse, G; Drache, M The crystal structure of potassium tetrachlorosulfatoborate, K (B (S O~3~ Cl)~4~) Acta Crystallographica B (24,1968-38,1982) 34 (1978) 1771-1776

130,149

2020-10-21

18:00:00

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1,004,040

9.302

null

9.302

null

9.302

null

90

null

90

null

90

null

804.9

null

3

P n -3 :2

-P 2ab 2bc 3

201

Bismuth ruthenium oxide (3/3/11)

- Bi3 O11 Ru3 -

- Bi12 O44 Ru12 -

4

0.166667

Abraham, F; Thomas, D

Structure cristalline de Bi~3~ Ru~3~ O~11~

Bulletin de la Societe Chimique de France (Vol=Year)

1,975

25

29

null

0.069

null

has coordinates

Abraham, F; Thomas, D Structure cristalline de Bi~3~ Ru~3~ O~11~ Bulletin de la Societe Chimique de France (Vol=Year) 1975 (1975) 25-29

176,729

2020-10-21

18:00:00

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1,004,041

8.126

0.004

7.978

0.003

6.762

0.004

103.36

0.03

90.98

0.03

97.86

0.03

422

null

5

P -1

-P 1

2

Tripotassium imidobis(sulfonate) hydrate

- H2 K3 N O7 S2 -

- H4 K6 N2 O14 S4 -

2

1

Barbier, P; Parent, Y; Mairesse, G

Crystal structure of K~3~ N (S O~3~)~2~ H~2~ O (I) and refinement of the crystal structure of K~2~ N H (S O~3~)~2~ (II)

Acta Crystallographica B (24,1968-38,1982)

1,979

35

1308

1312

10.1107/S0567740879006324

null

0.029

null

has coordinates

Barbier, P; Parent, Y; Mairesse, G Crystal structure of K~3~ N (S O~3~)~2~ H~2~ O (I) and refinement of the crystal structure of K~2~ N H (S O~3~)~2~ (II) Acta Crystallographica B (24,1968-38,1982) 35 (1979) 1308-1312

130,149

2020-10-21

18:00:00

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1,004,042

12.456

0.005

7.483

0.004

7.185

0.004

90

null

91.24

0.02

90

null

669.5

null

5

P 1 2/c 1

-P 2yc

13

Dipotassium imidobis(sulfonate)

- H K2 N O6 S2 -

- H2 K4 N2 O12 S4 -

2

0.5

Barbier, P; Parent, Y; Mairesse, G

Crystal structure of K~3~ N (S O~3~)~2~ H~2~ O (I) and fefinement of the crystal structure of K~2~ N H (S O~3~)~2~ (II)

Acta Crystallographica B (24,1968-38,1982)

1,979

35

1308

1312

10.1107/S0567740879006324

null

0.043

null

has coordinates

Barbier, P; Parent, Y; Mairesse, G Crystal structure of K~3~ N (S O~3~)~2~ H~2~ O (I) and fefinement of the crystal structure of K~2~ N H (S O~3~)~2~ (II) Acta Crystallographica B (24,1968-38,1982) 35 (1979) 1308-1312

301,771

2025-08-18

12:22:44

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7,205,931

9.5346

0.0006

9.5932

0.0006

13.9476

0.0009

96.674

0.005

105.479

0.006

94.841

0.005

1,212.24

0.14

173

2

173

2

null

2

P -1

-P 1

2

- C36 H24 -

- C72 H48 -

2

1

Zhao, Zujin; Chen, Shuming; Lam, Jacky W. Y.; Wang, Zhiming; Lu, Ping; Mahtab, Faisal; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Kwok, Hoi Sing; Tang, Ben Zhong

Pyrene-substituted ethenes: aggregation-enhanced excimer emission and highly efficient electroluminescence

Journal of Materials Chemistry

2,011

21

20

7210

10.1039/c0jm04449k

1.54178

CuKα

0.0476

0.0381

null

0.096

0.0994

null

1.012

null

has coordinates

Zhao, Zujin; Chen, Shuming; Lam, Jacky W. Y.; Wang, Zhiming; Lu, Ping; Mahtab, Faisal; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Kwok, Hoi Sing; Tang, Ben Zhong Pyrene-substituted ethenes: aggregation-enhanced excimer emission and highly efficient electroluminescence Journal of Materials Chemistry 21(20) (2011...

301,863

2025-08-22

13:07:26

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1,004,043

9.886

0.003

6.617

0.002

10.322

0.003

90

null

90

null

90

null

675.2

null

3

P 21 21 21

P 2ac 2ab

19

Sodium tetrachloroaluminate

- Al Cl4 Na -

- Al4 Cl16 Na4 -

4

1

Mairesse, G; Barbier, P; Wignacourt, J P

Comparison of the crystal structures of alkaline (M = Li, Na, K, Rb, Cs) and Pseudo-alkaline (M = N O, N H~4~) Tetrachloroaluminates, M Al Cl~4~

Acta Crystallographica B (24,1968-38,1982)

1,979

35

1573

1580

10.1107/S0567740879007160

null

0.025

null

has coordinates

Mairesse, G; Barbier, P; Wignacourt, J P Comparison of the crystal structures of alkaline (M = Li, Na, K, Rb, Cs) and Pseudo-alkaline (M = N O, N H~4~) Tetrachloroaluminates, M Al Cl~4~ Acta Crystallographica B (24,1968-38,1982) 35 (1979) 1573-1580

130,149

2020-10-21

18:00:00

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1,004,044

11.641

0.008

7.116

0.005

9.373

0.007

90

null

90

null

90

null

776.4

null

3

P n m a

-P 2ac 2n

62

Caesium tetrachloroaluminate

- Al Cl4 Cs -

- Al4 Cl16 Cs4 -

4

0.5

Mairesse, G; Barbier, P; Wignacourt, J P

Comparison of the crystal structures of alkaline (M = Li, Na, K, Rb, Cs) and Pseudo-alkaline (M = N O, N H~4~) Tetrachloroaluminates, M Al Cl~4~

Acta Crystallographica B (24,1968-38,1982)

1,979

35

1573

1580

10.1107/S0567740879007160

null

0.047

null

has coordinates

Mairesse, G; Barbier, P; Wignacourt, J P Comparison of the crystal structures of alkaline (M = Li, Na, K, Rb, Cs) and Pseudo-alkaline (M = N O, N H~4~) Tetrachloroaluminates, M Al Cl~4~ Acta Crystallographica B (24,1968-38,1982) 35 (1979) 1573-1580

130,149

2020-10-21

18:00:00

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1,004,045

9.997

0.003

5.477

0.002

18.443

0.01

90

null

90

null

90

null

1,009.8

null

4

P n a m

-P 2c 2n

62

Indium hydrogenbis(sulfate) tetrahydrate

- H9 In O12 S2 -

- H8.5 In O12 S2 -

- H34 In4 O48 S8 -

4

0.5

Tudo, J; Jolibois, B; Laplace, G; Nowogrocki, G

Structure cristalline du sulfate acide d'indium(III) hydrate

Acta Crystallographica B (24,1968-38,1982)

1,979

35

1580

1583

10.1107/S0567740879007172

null

0.033

null

has coordinates

Tudo, J; Jolibois, B; Laplace, G; Nowogrocki, G Structure cristalline du sulfate acide d'indium(III) hydrate Acta Crystallographica B (24,1968-38,1982) 35 (1979) 1580-1583

130,149

2020-10-21

18:00:00

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1,004,046

23.024

0.01

5.181

0.003

8.9

0.004

90

null

90

null

90

null

1,061.7

null

3

P n n m

-P 2 2n

58

Dibarium hexairon(III) oxide

- Ba2 Fe6 O11 -

- Ba8 Fe24 O44 -

4

0.5

Boivin, J C; Thomas, D; Pouillard, G; Perrot, P

Determination de la structure cristalline du ferrite de baryium Ba Fe~6~ O~11~

Journal of Solid State Chemistry

1,979

29

101

108

10.1016/0022-4596(79)90213-5

null

0.045

null

has coordinates

Boivin, J C; Thomas, D; Pouillard, G; Perrot, P Determination de la structure cristalline du ferrite de baryium Ba Fe~6~ O~11~ Journal of Solid State Chemistry 29 (1979) 101-108

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004046.cif $ #-------------------------------------------------------------------...

1,004,047

7.911

0.002

7.963

0.002

6.966

0.002

90

null

115.76

0.02

90

null

395.2

null

3

C 1 2/m 1

-C 2y

12

Trilanthanum decaoxodiosmate(II)

- La3 O10 Os2 -

- La6 O20 Os4 -

2

0.25

Abraham, F; Trehoux, J; Thomas, D

L A Os~2~ O~10~, a new compound containing isolated clusters Os~2~ O~10~ with metal-metal bonds

Journal of Solid State Chemistry

1,979

29

73

79

10.1016/0022-4596(79)90210-X

null

0.025

null

has coordinates

Abraham, F; Trehoux, J; Thomas, D L A Os~2~ O~10~, a new compound containing isolated clusters Os~2~ O~10~ with metal-metal bonds Journal of Solid State Chemistry 29 (1979) 73-79

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004047.cif $ #-------------------------------------------------------------------...

1,004,048

6.852

0.015

11.984

0.008

6.996

0.006

90

null

113.38

0.05

90

null

527.3

null

5

P 1 21/c 1

-P 2ybc

14

Potassium Diaquatetrabromoindate

- Br4 H4 In K O2 -

- Br8 H8 In2 K2 O4 -

2

0.5

Wignacourt, J P; Mairesse, G; Barbier, P

Potassium Diaquatetrabromoindate(III)

Acta Crystallographica B (24,1968-38,1982)

1,980

36

669

671

10.1107/S0567740880004062

null

0.046

null

has coordinates

Wignacourt, J P; Mairesse, G; Barbier, P Potassium Diaquatetrabromoindate(III) Acta Crystallographica B (24,1968-38,1982) 36 (1980) 669-671

301,771

2025-08-18

12:22:44

#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:21:50 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301771 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004048.cif $ #-------------------------------------------------------------------...

7,205,930

7.176

0.0002

7.176

0.0002

13.6663

0.0006

90

null

90

null

90

null

703.75

0.04

100

1

100

1

null

5

P 4/m m m

-P 4 2

123

- C23.08 H8 Fe N6 Pt -

1

0.0625

Bartual-Murgui, Carlos; Ortega-Villar, Norma A.; Shepherd, Helena J.; Muñoz, M. Carmen; Salmon, Lionel; Molnár, Gábor; Bousseksou, Azzedine; Real, José Antonio

Enhanced porosity in a new 3D Hofmann-like network exhibiting humidity sensitive cooperative spin transitions at room temperature

Journal of Materials Chemistry

2,011

21

20

7217

10.1039/c0jm04387g

0.71073

MoKα

0.0549

0.049

null

0.1401

0.1685

null

1.097

null

has coordinates

Bartual-Murgui, Carlos; Ortega-Villar, Norma A.; Shepherd, Helena J.; Muñoz, M. Carmen; Salmon, Lionel; Molnár, Gábor; Bousseksou, Azzedine; Real, José Antonio Enhanced porosity in a new 3D Hofmann-like network exhibiting humidity sensitive cooperative spin transitions at room temperature Journal of Materials Chemistry...

176,432

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176432 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205930.cif $ #-------------------------------------------------------------------...

1,004,049

11.994

null

5.609

null

3.856

null

90

null

90

null

90

null

259.4

null

3

P m m m

-P 2 2

47

LANTHANUM RUTHENIUM OXIDE (3.5/4/13)

- La3.5 O13 Ru4 -

1

0.125

Abraham, F; Trehoux, J; Thomas, D

La~3.5~ Ru~4~ O~13~: Un Nouveau Compose a Feuillets de Type Perovskite

Journal of Solid State Chemistry

1,980

32

151

160

10.1016/0022-4596(80)90561-7

null

0.029

null

has coordinates

Abraham, F; Trehoux, J; Thomas, D La~3.5~ Ru~4~ O~13~: Un Nouveau Compose a Feuillets de Type Perovskite Journal of Solid State Chemistry 32 (1980) 151-160

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004049.cif $ #-------------------------------------------------------------------...

1,004,050

7.359

0.003

12.513

0.006

7.704

0.005

90

null

90

null

90

null

709.4

null

3

F m m 2

F 2 -2

42

Tungsten oxide 0.3-hydrate

- H0.66 O3.33 W -

- H0.833333 O3.33333 W -

- H10 O40 W12 -

12

0.75

Gerand, B; Nowogrocki, G; Figlarz, M

A new tungsten trioxide hydrate, W O~3~ (H~2~ O)~0.33~: Preparation, characterization and crystallographic study

Journal of Solid State Chemistry

1,981

38

312

320

10.1016/0022-4596(81)90062-1

null

0.057

null

has coordinates

Gerand, B; Nowogrocki, G; Figlarz, M A new tungsten trioxide hydrate, W O~3~ (H~2~ O)~0.33~: Preparation, characterization and crystallographic study Journal of Solid State Chemistry 38 (1981) 312-320

176,435

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004050.cif $ #-------------------------------------------------------------------...

1,004,051

8.51

0.001

8.51

0.001

5.814

0.001

90

null

90

null

90

null

421.1

null

3

P 4/n c c :1

P 4ab 2n -1ab

130

Bismuth copper oxide

- Bi2 Cu O4 -

- Bi8 Cu4 O16 -

4

0.25

Boivin, J C; Trehoux, J; Thomas, D

Etude structurale de Cu Bi~2~ O~4~

Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)

1,976

99

193

196

null

0.054

null

has coordinates

Boivin, J C; Trehoux, J; Thomas, D Etude structurale de Cu Bi~2~ O~4~ Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 99 (1976) 193-196

176,729

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004051.cif $ #-------------------------------------------------------------------...

1,004,052

9.75

null

9.75

null

9.75

null

23.49

null

23.49

null

23.49

null

129.3

null

3

R -3 m :R

-P 3* 2

166

Bismuth strontium oxide (.8/.2/1.1)

- Bi0.76 O1.11 Sr0.23 -

- Bi0.765 O1.11133 Sr0.235 -

- Bi2.295 O3.334 Sr0.705 -

3

0.25

Conflant, P; Boivin, J C; Thomas, D

Etude structurale du conducteur anionique Bi~0.765~ Sr~0.235~ O~1.383~

Journal of Solid State Chemistry

1,980

35

192

199

10.1016/0022-4596(80)90493-4

null

0.03

null

has coordinates

Conflant, P; Boivin, J C; Thomas, D Etude structurale du conducteur anionique Bi~0.765~ Sr~0.235~ O~1.383~ Journal of Solid State Chemistry 35 (1980) 192-199

176,435

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004052.cif $ #-------------------------------------------------------------------...

1,004,053

8.963

0.007

15.644

0.015

9.131

0.006

90

null

108.28

0.05

90

null

1,215.7

null

5

P 1 21/c 1

-P 2ybc

14

Triammonium indium sulfate

- H12 In N3 O12 S3 -

- H48 In4 N12 O48 S12 -

4

1

Jolibois, B; Laplace, G; Abraham, F; Nowogrocki, G

The Low-Temperature Forms of some M(I)~3~ M(III) (X O~4~)~3~ Compounds: Structure of Triammonium indium(III) Trisulfate

Acta Crystallographica B (24,1968-38,1982)

1,980

36

2517

2519

10.1107/S0567740880009338

null

0.015

null

has coordinates

Jolibois, B; Laplace, G; Abraham, F; Nowogrocki, G The Low-Temperature Forms of some M(I)~3~ M(III) (X O~4~)~3~ Compounds: Structure of Triammonium indium(III) Trisulfate Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2517-2519

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004053.cif $ #-------------------------------------------------------------------...

1,004,054

8.832

0.005

8.388

0.004

20.765

0.008

90

null

91.89

0.05

90

null

1,537.5

null

5

P 1 21/c 1

-P 2ybc

14

Lithium tetrakis(chlorosulfato)borate

- B Cl4 Li O12 S4 -

- B4 Cl16 Li4 O48 S16 -

4

1

Mairesse, G; Drache, M

Lithium Tetrakis(chlorosulfato)borate

Acta Crystallographica B (24,1968-38,1982)

1,980

36

2767

2768

10.1107/S0567740880009958

null

0.04

null

has coordinates

Mairesse, G; Drache, M Lithium Tetrakis(chlorosulfato)borate Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2767-2768

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004054.cif $ #-------------------------------------------------------------------...

1,004,055

10.048

0.003

10.048

0.003

10.048

0.003

90

null

90

null

90

null

1,014.5

null

4

F m -3 m

-F 4 2 3

225

Hexaammineruthenium(II) chloride

- Cl2 H18 N6 Ru -

- Cl8 H72 N24 Ru4 -

4

0.020833

Trehoux, J; Nowogrocki, G; Thomas, D

Determination de la structure du chlorure de ruthenium(II) hexaammine. Longueur de la liaison ruthenium(II) - azote.

Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-)

1,972

274

1384

1387

null

0.038

null

has coordinates

Trehoux, J; Nowogrocki, G; Thomas, D Determination de la structure du chlorure de ruthenium(II) hexaammine. Longueur de la liaison ruthenium(II) - azote. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 274 (1972) 1384-1387

301,771

2025-08-18

12:22:44

#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:21:50 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301771 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004055.cif $ #-------------------------------------------------------------------...

7,205,929

7.231

0.0008

7.231

0.0008

13.812

0.004

90

null

90

null

90

null

722.2

0.2

120

1

120

1

null

6

P 4/m m m

-P 4 2

123

- C19 Cl1.56 Fe N6 O0.52 Pt -

1

0.0625

Bartual-Murgui, Carlos; Ortega-Villar, Norma A.; Shepherd, Helena J.; Muñoz, M. Carmen; Salmon, Lionel; Molnár, Gábor; Bousseksou, Azzedine; Real, José Antonio

Enhanced porosity in a new 3D Hofmann-like network exhibiting humidity sensitive cooperative spin transitions at room temperature

Journal of Materials Chemistry

2,011

21

20

7217

10.1039/c0jm04387g

0.71073

MoKα

0.1092

0.0902

null

0.2335

0.2481

null

1.049

null

has coordinates

Bartual-Murgui, Carlos; Ortega-Villar, Norma A.; Shepherd, Helena J.; Muñoz, M. Carmen; Salmon, Lionel; Molnár, Gábor; Bousseksou, Azzedine; Real, José Antonio Enhanced porosity in a new 3D Hofmann-like network exhibiting humidity sensitive cooperative spin transitions at room temperature Journal of Materials Chemistry...

278,046

2022-09-21

15:45:42

#------------------------------------------------------------------------------ #$Date: 2022-09-21 18:44:46 +0300 (Wed, 21 Sep 2022) $ #$Revision: 278046 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205929.cif $ #-------------------------------------------------------------------...

1,004,056

9.302

null

9.302

null

9.302

null

90

null

90

null

90

null

804.9

null

3

P n -3 :2

-P 2ab 2bc 3

201

Tribismuth triruthenium undecaoxide

- Bi3 O11 Ru3 -

- Bi12 O44 Ru12 -

4

0.166667

Abraham, F; Thomas, D; Nowogrocki, G

Structure cristalline de Bi~3~ Ru~3~ O~11~

Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)

1,975

98

25

29

null

0.069

null

1,004,040

null

has coordinates

Abraham, F; Thomas, D; Nowogrocki, G Structure cristalline de Bi~3~ Ru~3~ O~11~ Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 98 (1975) 25-29

287,519

2023-11-10

19:29:20

#------------------------------------------------------------------------------ #$Date: 2023-11-10 21:21:08 +0200 (Fri, 10 Nov 2023) $ #$Revision: 287519 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004056.cif $ #-------------------------------------------------------------------...

1,004,057

7.298

0.002

7.298

0.002

3.899

0.002

90

null

90

null

120

null

179.8

null

2

P 6/m m m

-P 6 2

191

TUNGSTEN OXIDE

- O3 W -

- O9 W3 -

3

0.125

Gerand, B; Nowogrocki, G; Guenot, J; Figlarz, M

Structural study of a new hexagonal form of tungsten trioxide

Journal of Solid State Chemistry

1,979

29

429

434

10.1016/0022-4596(79)90199-3

null

0.055

null

has coordinates

Gerand, B; Nowogrocki, G; Guenot, J; Figlarz, M Structural study of a new hexagonal form of tungsten trioxide Journal of Solid State Chemistry 29 (1979) 429-434

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004057.cif $ #-------------------------------------------------------------------...

1,004,058

7.758

0.003

17.587

0.009

7.356

0.003

90

null

119.91

0.03

90

null

870

null

4

C 1 c 1

C -2yc

9

Dithallium thallium(III) hydroxide bis(sulfate)

- H O9 S2 Tl3 -

- H4 O36 S8 Tl12 -

4

1

Abraham, F; Nowogrocki, G; Jolibois, B; Laplace, G

On Basic Thallium Sulfates: Structure of Tl~2~ Tl OH(SO~4~)~2~

Journal of Solid State Chemistry

1,983

47

1

5

10.1016/0022-4596(83)90033-6

null

0.033

null

has coordinates

Abraham, F; Nowogrocki, G; Jolibois, B; Laplace, G On Basic Thallium Sulfates: Structure of Tl~2~ Tl OH(SO~4~)~2~ Journal of Solid State Chemistry 47 (1983) 1-5

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004058.cif $ #-------------------------------------------------------------------...

1,004,059

10.322

0.003

9.886

0.003

6.167

0.002

90

null

90

null

90

null

629.3

null

3

P 21 21 21

P 2ac 2ab

19

Sodium tetrachloroaluminate

- Al Cl4 Na -

- Al4 Cl16 Na4 -

4

1

Wallart, F; Lorriaux-Rubbens, A; Mairesse, G; Barbier, P; Wignacourt, J P

Etude Structurale du Tetrachloroaluminate de Sodium: Comparaison des Spectres de Diffusion Raman de la Famille des M Al Cl~4~ (M= Li, Na, K, Rb, Cs, NO, NH~4~) a l'Etat Solide

Journal of Raman Spectroscopy

1,980

9

55

61

10.1002/jrs.1250090113

null

0.025

null

has coordinates

Wallart, F; Lorriaux-Rubbens, A; Mairesse, G; Barbier, P; Wignacourt, J P Etude Structurale du Tetrachloroaluminate de Sodium: Comparaison des Spectres de Diffusion Raman de la Famille des M Al Cl~4~ (M= Li, Na, K, Rb, Cs, NO, NH~4~) a l'Etat Solide Journal of Raman Spectroscopy 9 (1980) 55-61

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004059.cif $ #-------------------------------------------------------------------...

1,004,060

10.411

0.008

7.055

0.003

9.461

0.005

90

null

90

null

90

null

694.9

null

4

P n m a

-P 2ac 2n

62

Nitrosyl tetrachloroaluminate

- Al Cl4 N O -

- Al4 Cl16 N4 O4 -

4

0.5

Barbier, P; Mairesse, G; Wignacourt, J P; Baert, F

Nitrosyl tetrachloroaluminate N O Al Cl~4~

Crystal Structure Communications

1,976

5

633

637

null

0.042

null

has coordinates

Barbier, P; Mairesse, G; Wignacourt, J P; Baert, F Nitrosyl tetrachloroaluminate N O Al Cl~4~ Crystal Structure Communications 5 (1976) 633-637

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004060.cif $ #-------------------------------------------------------------------...

1,004,061

8.981

0.003

8.981

0.003

8.981

0.003

90

null

90

null

90

null

724.4

null

3

I 2 3

I 2 2 3

197

LANTHANUM RUTHENIUM OXIDE (4/6/19)

- La4 O19 Ru6 -

- La8 O38 Ru12 -

2

0.083333

Abraham, F; Trehoux, J; Thomas, D

La liaison metal-metal dans les clusters M~12~ O~36~: I - preparation et etudes structurale des phases La~4~ M~6~ O~19~ (M = Ru, Os)

Materials Research Bulletin

1,977

12

43

52

10.1016/0025-5408(77)90087-3

null

0.025

null

has coordinates

Abraham, F; Trehoux, J; Thomas, D La liaison metal-metal dans les clusters M~12~ O~36~: I - preparation et etudes structurale des phases La~4~ M~6~ O~19~ (M = Ru, Os) Materials Research Bulletin 12 (1977) 43-52

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004061.cif $ #-------------------------------------------------------------------...

7,205,928

7.17

0.0002

7.17

0.0002

13.662

0.0002

90

null

90

null

90

null

702.35

0.03

120

1

120

1

null

4

P 4/m m m

-P 4 2

123

- C22.08 Fe N7.04 Pt -

1

0.0625

Bartual-Murgui, Carlos; Ortega-Villar, Norma A.; Shepherd, Helena J.; Muñoz, M. Carmen; Salmon, Lionel; Molnár, Gábor; Bousseksou, Azzedine; Real, José Antonio

Enhanced porosity in a new 3D Hofmann-like network exhibiting humidity sensitive cooperative spin transitions at room temperature

Journal of Materials Chemistry

2,011

21

20

7217

10.1039/c0jm04387g

0.71073

MoKα

0.0319

0.0311

null

0.0794

0.0798

null

0.859

null

has coordinates

Bartual-Murgui, Carlos; Ortega-Villar, Norma A.; Shepherd, Helena J.; Muñoz, M. Carmen; Salmon, Lionel; Molnár, Gábor; Bousseksou, Azzedine; Real, José Antonio Enhanced porosity in a new 3D Hofmann-like network exhibiting humidity sensitive cooperative spin transitions at room temperature Journal of Materials Chemistry...

278,046

2022-09-21

15:45:42

#------------------------------------------------------------------------------ #$Date: 2022-09-21 18:44:46 +0300 (Wed, 21 Sep 2022) $ #$Revision: 278046 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205928.cif $ #-------------------------------------------------------------------...

1,004,062

9.05

0.002

9.05

0.002

9.05

0.002

90

null

90

null

90

null

741.2

null

3

I 2 3

I 2 2 3

197

LANTHANUM OSMIUM OXIDE (4/6/19)

- La4 O19 Os6 -

- La8 O38 Os12 -

2

0.083333

Abraham, F; Trehoux, J; Thomas, D

La liaison metal-metal dans les clusters M~12~ O~36~: I - preparation et etudes structurale des phases La~4~ M~6~ O~19~ (M = Ru, Os)

Materials Research Bulletin

1,977

12

43

52

10.1016/0025-5408(77)90087-3

null

0.024

null

has coordinates

Abraham, F; Trehoux, J; Thomas, D La liaison metal-metal dans les clusters M~12~ O~36~: I - preparation et etudes structurale des phases La~4~ M~6~ O~19~ (M = Ru, Os) Materials Research Bulletin 12 (1977) 43-52

130,149

2020-10-21

18:00:00

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1,004,063

9.466

0.002

9.466

0.002

9.466

0.002

90

null

90

null

90

null

848.2

null

3

P n -3 :2

-P 2ab 2bc 3

201

LANTHANUM RUTHENIUM OXIDE (3/3/11)

- La3 O11 Ru3 -

- La12 O44 Ru12 -

4

0.166667

Abraham, F; Trehoux, J; Thomas, D

La liaison metal-metal dans les clusters M~12~ O~36~: II-Preparation et etude structurelle de la phase La~3~ Ru~3~ O~11~

Materials Research Bulletin

1,978

13

805

810

10.1016/0025-5408(78)90043-0

null

0.022

null

has coordinates

Abraham, F; Trehoux, J; Thomas, D La liaison metal-metal dans les clusters M~12~ O~36~: II-Preparation et etude structurelle de la phase La~3~ Ru~3~ O~11~ Materials Research Bulletin 13 (1978) 805-810

176,729

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004063.cif $ #-------------------------------------------------------------------...

1,004,064

8.622

0.004

8.622

0.004

5.907

0.003

90

null

90

null

90

null

439.1

null

3

P 4/n c c :2

-P 4a 2ac

130

Palladium dibismuth oxide

- Bi2 O4 Pd -

- Bi8 O16 Pd4 -

4

0.25

Conflant, P.; Boivin, J. C.; Thomas, D.

Etude de la serie isostructurale M(II)Bi~2~O~4~: PbBi~2~O~4~

Revue de Chimie Minerale

1,977

14

249

255

null

0.041

null

has coordinates

Conflant, P.; Boivin, J. C.; Thomas, D. Etude de la serie isostructurale M(II)Bi~2~O~4~: PbBi~2~O~4~ Revue de Chimie Minerale 14 (1977) 249-255

200,126

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2017-09-02 15:02:44 +0300 (Sat, 02 Sep 2017) $ #$Revision: 200126 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004064.cif $ #-------------------------------------------------------------------...

1,004,065

11.022

0.006

7.072

0.003

9.257

0.005

90

null

90

null

90

null

721.6

null

4

P n m a

-P 2ac 2n

62

AMMONIUM TETRACHLOROALUMINATE

- Al Cl4 H4 N -

- Al4 Cl16 H16 N4 -

4

0.5

Mairesse, G; Barbier, P; Wignacourt, J P; Rubbens, A; Wallart, F

X-ray, Raman, infrared, and nuclear magnetic resonance studies of the crystal structure of ammonium tetrachloroaluminate, N H~4~ Al Cl~4~

Canadian Journal of Chemistry

1,978

56

764

771

10.1139/v78-127

null

0.027

null

has coordinates

Mairesse, G; Barbier, P; Wignacourt, J P; Rubbens, A; Wallart, F X-ray, Raman, infrared, and nuclear magnetic resonance studies of the crystal structure of ammonium tetrachloroaluminate, N H~4~ Al Cl~4~ Canadian Journal of Chemistry 56 (1978) 764-771

200,452

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2017-09-11 16:25:09 +0300 (Mon, 11 Sep 2017) $ #$Revision: 200452 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004065.cif $ #-------------------------------------------------------------------...

7,205,927

21.887

0.015

11.094

0.007

20.234

0.013

90

null

105.373

0.007

90

null

4,737

5

293

2

293

2

null

7

P 1 21/c 1

-P 2ybc

14

- C46 H39 F12 N4 O0.5 Os P4 -

- C46 H38 F12 N4 O0.5 Os P4 -

- C184 H152 F48 N16 O2 Os4 P16 -

4

1

Yang, Tianshe; Xia, Ao; Liu, Qian; Shi, Mei; Wu, Huazhou; Xiong, Liqin; Huang, Chunhui; Li, Fuyou

Polymer nanoparticles with an embedded phosphorescent osmium(ii) complex for cell imaging

Journal of Materials Chemistry

2,011

21

14

5360

10.1039/c0jm04235h

0.71073

MoKα

0.0524

0.0381

null

0.0941

0.1007

null

1.001

null

has coordinates

Yang, Tianshe; Xia, Ao; Liu, Qian; Shi, Mei; Wu, Huazhou; Xiong, Liqin; Huang, Chunhui; Li, Fuyou Polymer nanoparticles with an embedded phosphorescent osmium(ii) complex for cell imaging Journal of Materials Chemistry 21(14) (2011) 5360

176,453

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $ #$Revision: 176453 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205927.cif $ #-------------------------------------------------------------------...

1,004,066

9.499

0.004

9.499

0.004

9.499

0.004

90

null

90

null

90

null

857.1

null

3

P n -3 :2

-P 2ab 2bc 3

201

LANTHANUM IRIDIUM OXIDE (3/3/11)

- Ir3 La3 O11 -

- Ir12 La12 O44 -

4

0.166667

Abraham, F; Trehoux, J; Thomas, D

Preparation et etude structurale d'un nouveau compose contenant le cluster M~12~ O~36~ * La~3~ Ir~3~ O~11~

Journal of the Less-Common Metals

1,979

63

P57

P63

10.1016/0022-5088(79)90255-8

null

0.037

null

has coordinates

Abraham, F; Trehoux, J; Thomas, D Preparation et etude structurale d'un nouveau compose contenant le cluster M~12~ O~36~ * La~3~ Ir~3~ O~11~ Journal of the Less-Common Metals 63 (1979) P57-P63

176,729

2020-10-21

18:00:00

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1,004,067

14.859

null

7.55

null

5.487

null

90

null

90

null

90

null

615.6

null

3

P n a 21

P 2c -2n

33

NEODYMIUM TETRAOXOOSMATE(V)

- Nd O4 Os -

- Nd8 O32 Os8 -

8

2

Abraham, F; Trehoux, J; Thomas, D

Crystal structure of Nd Os O~4~ a new Ba Zn F~4~ -type compound

Journal of Inorganic and Nuclear Chemistry

1,980

42

1627

1630

10.1016/0022-1902(80)80327-7

null

0.047

null

has coordinates

Abraham, F; Trehoux, J; Thomas, D Crystal structure of Nd Os O~4~ a new Ba Zn F~4~ -type compound Journal of Inorganic and Nuclear Chemistry 42 (1980) 1627-1630

130,149

2020-10-21

18:00:00

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1,004,068

8.957

0.003

8.957

0.003

8.957

0.003

90

null

90

null

90

null

718.6

null

3

I 2 3

I 2 2 3

197

Neodymium osmium oxide (4/6/19)

- Nd4 O19 Os6 -

- Nd8 O38 Os12 -

2

0.083333

Abraham, F; Trehoux, J; Thomas, D

Caracterisation et structure d'un nouvel oxyde de neodyme et d'osmium derive du type K Sb O~3~-cubique: Nd~4~ Os~6~ O~19~

Journal of the Less-Common Metals

1,981

77

P23

P30

10.1016/0022-5088(81)90182-X

null

0.027

null

has coordinates

Abraham, F; Trehoux, J; Thomas, D Caracterisation et structure d'un nouvel oxyde de neodyme et d'osmium derive du type K Sb O~3~-cubique: Nd~4~ Os~6~ O~19~ Journal of the Less-Common Metals 77 (1981) P23-P30

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004068.cif $ #-------------------------------------------------------------------...

1,004,069

10.322

0.003

9.886

0.003

6.167

0.002

90

null

90

null

90

null

629.3

null

3

P 21 21 21

P 2ac 2ab

19

SODIUM TETRACHLOROALUMINATE

- Al Cl4 Na -

- Al4 Cl16 Na4 -

4

1

Wallart, F; Lorriaux-Rubbens, A; Mairesse, G; Barbier, P; Wignacourt, J P

Etude structurale du tetrachloroaluminate de sodium. Comparaison des spectres de diffusion raman de la famille des M Al Cl~4~ (M=Li, Na, K, Rb, Cs, No, Nh~4~,) a l'etat solide

Journal of Raman Spectroscopy

1,980

9

55

61

10.1002/jrs.1250090113

null

0.025

null

has coordinates

Wallart, F; Lorriaux-Rubbens, A; Mairesse, G; Barbier, P; Wignacourt, J P Etude structurale du tetrachloroaluminate de sodium. Comparaison des spectres de diffusion raman de la famille des M Al Cl~4~ (M=Li, Na, K, Rb, Cs, No, Nh~4~,) a l'etat solide Journal of Raman Spectroscopy 9 (1980) 55-61

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004069.cif $ #-------------------------------------------------------------------...

1,004,070

13.905

0.008

9.952

0.005

7.185

0.005

90

null

90

null

90

null

994.3

null

5

P n m a

-P 2ac 2n

62

DIPOTASSIUM PENTACHLOROAQUAINDATE

- Cl5 H2 In K2 O -

- Cl20 H8 In4 K8 O4 -

4

0.5

Wignacourt, J P; Lorriaux-Rubbens, A; Barbier, P; Mairesse, G; Wallart, F

Structural stdudy of K~2~ In Cl~5~, H~2~ O by X-Ray, Raman and IR spectroscopies

Spectrochimica Acta A, Molecular Spectroscopy

1,980

36

403

411

10.1016/0584-8539(80)80153-X

null

0.028

null

has coordinates

Wignacourt, J P; Lorriaux-Rubbens, A; Barbier, P; Mairesse, G; Wallart, F Structural stdudy of K~2~ In Cl~5~, H~2~ O by X-Ray, Raman and IR spectroscopies Spectrochimica Acta A, Molecular Spectroscopy 36 (1980) 403-411

176,435

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004070.cif $ #-------------------------------------------------------------------...

7,205,926

21.657

0.003

21.657

0.003

57.01

0.02

90

null

90

null

90

null

26,739

11

200

2

200

2

null

5

I 41/a c d :2

-I 4bd 2c

142

Ti16

- C64 H142 Cl18 O48 Ti16 -

- C512 H1136 Cl144 O384 Ti128 -

8

0.25

Périneau, Fabien; Pensec, Sandrine; Sassoye, Capucine; Ribot, François; van Lokeren, Luk; Willem, Rudolph; Bouteiller, Laurent; Sanchez, Clément; Rozes, Laurence

New hybrid core–shell star-like architectures made of poly(n-butyl acrylate) grown from well-defined titanium oxo-clusters

Journal of Materials Chemistry

2,011

21

12

4470

10.1039/c0jm04047a

0.71073

MoKα

0.1577

0.0883

null

0.2802

0.3303

null

1.397

null

has coordinates,has disorder

Périneau, Fabien; Pensec, Sandrine; Sassoye, Capucine; Ribot, François; van Lokeren, Luk; Willem, Rudolph; Bouteiller, Laurent; Sanchez, Clément; Rozes, Laurence New hybrid core–shell star-like architectures made of poly(n-butyl acrylate) grown from well-defined titanium oxo-clusters Journal of Materials Chemistry 21(1...

301,863

2025-08-22

13:07:26

#------------------------------------------------------------------------------ #$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $ #$Revision: 301863 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205926.cif $ #-------------------------------------------------------------------...

1,004,071

3.971

0.001

3.971

0.001

28.41

0.01

90

null

90

null

120

null

388

null

3

R -3 m :H

-R 3 2"

166

BISMUTH STRONTIUM OXIDE (1.7/0.5/3)

- Bi1.72 O3 Sr0.53 -

- Bi1.72125 O3 Sr0.5295 -

- Bi6.885 O12 Sr2.118 -

4

0.111111

Boivin, J C; Thomas, D J

Structural investigations on bismuth-based oxides

Solid State Ionics

1,981

3

457

462

null

0.03

null

has coordinates

Boivin, J C; Thomas, D J Structural investigations on bismuth-based oxides Solid State Ionics 3 (1981) 457-462

176,435

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004071.cif $ #-------------------------------------------------------------------...

1,004,072

7.891

0.012

10.39

0.005

10.39

0.005

90

null

90

null

90

null

851.9

null

3

P n n a

-P 2a 2bc

52

Potassium tetrabromoindate

- Br4 In K -

- Br16 In4 K4 -

4

0.5

Wignacourt, J P; Mairesse, G; Abraham, F

Potassium Tetrabromoindate(III), K (In Br~4~)

Acta Crystallographica C (39,1983-)

1,984

40

2006

2007

null

0.052

null

has coordinates

Wignacourt, J P; Mairesse, G; Abraham, F Potassium Tetrabromoindate(III), K (In Br~4~) Acta Crystallographica C (39,1983-) 40 (1984) 2006-2007

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004072.cif $ #-------------------------------------------------------------------...

1,004,073

4.281

0.001

4.281

0.001

4.281

0.001

90

null

90

null

90

null

78.5

null

3

I m -3 m

-I 4 2 3

229

Bismuth cadmium oxide (.79/.21/1.395)

- Bi0.79 Cd0.21 O1.395 -

- Bi0.79 Cd0.21 O1.38 -

- Bi1.58 Cd0.42 O2.76 -

2

0.020833

Graia, T; Conflant, P; Nowogrocki, G; Boivin, J C; Thomas, D

Stability range and crystal structure of the oxygen-deficient b.c.c. solid solution Bi(~1-x~) Cd~x~ O(~1.5-x/2~) (0.11<x<.25)

Journal of Solid State Chemistry

1,986

63

160

165

10.1016/0022-4596(86)90166-0

null

0.037

null

has coordinates

Graia, T; Conflant, P; Nowogrocki, G; Boivin, J C; Thomas, D Stability range and crystal structure of the oxygen-deficient b.c.c. solid solution Bi(~1-x~) Cd~x~ O(~1.5-x/2~) (0.11<x<.25) Journal of Solid State Chemistry 63 (1986) 160-165

176,435

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004073.cif $ #-------------------------------------------------------------------...

1,004,074

4.005

0.001

4.005

0.001

28.54

0.01

90

null

90

null

120

null

396.5

null

3

R -3 m :H

-R 3 2"

166

Bismuth barium oxide (.844/.156/1.422)

- Ba0.156 Bi0.844 O1.422 -

- Ba0.468 Bi2.532 O4.266 -

3

0.083333

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D

Etude structurale par diffractometrie X a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~

Solid State Ionics

1,983

9

925

928

null

has coordinates

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D Etude structurale par diffractometrie X a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~ Solid State Ionics 9 (1983) 925-928

176,435

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004074.cif $ #-------------------------------------------------------------------...

1,004,075

4.023

0.001

4.023

0.001

28.66

0.01

90

null

90

null

120

null

401.7

null

3

R -3 m :H

-R 3 2"

166

Bismuth barium oxide (.844/.156/1.422)

- Ba0.156 Bi0.844 O1.422 -

- Ba0.468 Bi2.532 O4.266 -

3

0.083333

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D

Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~

Solid State Ionics

1,983

9

925

928

null

has coordinates

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~ Solid State Ionics 9 (1983) 925-928

176,435

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004075.cif $ #-------------------------------------------------------------------...

1,004,076

4.025

0.001

4.025

0.001

28.71

0.01

90

null

90

null

120

null

402.8

null

3

R -3 m :H

-R 3 2"

166

Bismuth barium oxide (.844/.156/1.422)

- Ba0.156 Bi0.844 O1.422 -

- Ba0.468 Bi2.532 O4.266 -

3

0.083333

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D

Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~

Solid State Ionics

1,983

9

925

928

null

has coordinates

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~ Solid State Ionics 9 (1983) 925-928

176,435

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004076.cif $ #-------------------------------------------------------------------...

7,205,925

7.629

0.002

7.843

0.002

15.045

0.005

91.409

0.006

95.784

0.005

115.16

0.005

808.4

0.4

298

2

298

2

null

4

P -1

-P 1

2

Zinc(II) Anthraquinone-2,3-dicarboxylate

- C16 H14 O10 Zn -

- C32 H28 O20 Zn2 -

2

1

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.

Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks

Journal of Materials Chemistry

2,011

21

18

6595

10.1039/c0jm03907a

0.71073

MoKα

0.1681

0.0663

null

0.1036

0.1345

null

0.947

null

has coordinates

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K. Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks Journal of Materials Chemistry 21(18) (2011) 6595

180,390

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-03-26 17:22:32 +0200 (Sat, 26 Mar 2016) $ #$Revision: 180390 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205925.cif $ #-------------------------------------------------------------------...

1,004,077

4.032

0.001

4.032

0.001

28.76

0.01

90

null

90

null

120

null

404.9

null

3

R -3 m :H

-R 3 2"

166

Bismuth barium oxide (.844/.156/1.422)

- Ba0.156 Bi0.844 O1.422 -

- Ba0.468 Bi2.532 O4.266 -

3

0.083333

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D

Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~

Solid State Ionics

1,983

9

925

928

null

has coordinates

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~ Solid State Ionics 9 (1983) 925-928

176,435

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1,004,078

4.054

0.001

4.054

0.001

28.88

0.01

90

null

90

null

120

null

411.1

null

3

R -3 m :H

-R 3 2"

166

Bismuth barium oxide (.844/.156/1.422)

- Ba0.156 Bi0.844 O1.422 -

- Ba0.468 Bi2.532 O4.266 -

3

0.083333

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D

Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~

Solid State Ionics

1,983

9

925

928

null

has coordinates

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~ Solid State Ionics 9 (1983) 925-928

176,435

2020-10-21

18:00:00

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1,004,079

4.057

0.001

4.057

0.001

28.9

0.01

90

null

90

null

120

null

411.9

null

3

R -3 m :H

-R 3 2"

166

Bismuth barium oxide (.844/.156/1.422)

- Ba0.156 Bi0.844 O1.422 -

- Ba0.468 Bi2.532 O4.266 -

3

0.083333

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D

Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~

Solid State Ionics

1,983

9

925

928

null

has coordinates

Conflant, P; Boivin, J C; Nowogrocki, G; Thomas, D Etude structurale par diffractometrie x a haute temperature du conducteur anionique Bi~.844~ Ba~.156~ O~1.422~ Solid State Ionics 9 (1983) 925-928

176,435

2020-10-21

18:00:00

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1,004,080

9.866

0.004

9.866

0.004

3.131

0.002

90

null

90

null

90

null

304.8

null

3

I 4/m

-I 4

87

Potassium Ruthenium oxide (2/8/16)

- K2 O16 Ru8 -

1

0.0625

Djafri, F; Canonne, J; Abraham, F; Thomas, D

Insertion de lithium dans la phase de structure Hollandite: K~x~ Ru~8~ O~16~ (x=1.5)

Journal of the Less-Common Metals

1,985

109

323

329

10.1016/0022-5088(85)90063-3

null

0.026

null

has coordinates

Djafri, F; Canonne, J; Abraham, F; Thomas, D Insertion de lithium dans la phase de structure Hollandite: K~x~ Ru~8~ O~16~ (x=1.5) Journal of the Less-Common Metals 109 (1985) 323-329

130,149

2020-10-21

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1,004,081

13.957

0.004

13.858

0.004

7.095

0.002

90

null

112.8

0.03

90

null

1,265.1

null

4

C 1 2/c 1

-C 2yc

15

Tripotassium dibismuth vanadate

- Bi2 K3 O12 V3 -

- Bi8 K12 O48 V12 -

4

0.5

Debreuille-Gresse, M F; Abraham, F

Crystal structure and electrical properties of K~3~ Bi~2~ (V O~4~)~3~, a new potassium bismuth vanadate

Journal of Solid State Chemistry

1,987

71

466

471

10.1016/0022-4596(87)90256-8

null

0.05

null

has coordinates

Debreuille-Gresse, M F; Abraham, F Crystal structure and electrical properties of K~3~ Bi~2~ (V O~4~)~3~, a new potassium bismuth vanadate Journal of Solid State Chemistry 71 (1987) 466-471

130,149

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7,205,924

16.308

0.003

7.4101

0.0015

16.183

0.003

90

null

106.064

0.004

90

null

1,879.3

0.6

293

2

293

2

null

4

P 1 21/c 1

-P 2ybc

14

Ni(II) Anthraquinone-2,3-Dicarboxylic Acid

- C16 H20 Ni O13 -

- C64 H80 Ni4 O52 -

4

1

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.

Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic–organic frameworks

Journal of Materials Chemistry

2,011

21

18

6595

10.1039/c0jm03907a

0.71073

MoKα

0.1131

0.0622

null

0.1284

0.1587

null

1.083

null

has coordinates

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K. Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic–organic frameworks Journal of Materials Chemistry 21(18) (2011) 6595

301,863

2025-08-22

13:07:26

#------------------------------------------------------------------------------ #$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $ #$Revision: 301863 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205924.cif $ #-------------------------------------------------------------------...

1,004,082

27.017

0.017

8.252

0.008

13.121

0.01

90

null

99.7

0.11

90

null

2,883.4

null

3

C 1 2/c 1

-C 2yc

15

Tricaesium bismuth hexachloride

- Bi Cl6 Cs3 -

- Bi8 Cl48 Cs24 -

8

1

Benachenhou, F; Mairesse, G; Nowogrocki, G; Thomas, D

Structural studies of Cs-K-Bi mixed chlorides relation to the crystal structures of A~2~ B M X~6~, A~3~ M X~6~ and A~2~ M X~6~

Journal of Solid State Chemistry

1,986

65

13

26

10.1016/0022-4596(86)90085-X

null

0.069

null

has coordinates

Benachenhou, F; Mairesse, G; Nowogrocki, G; Thomas, D Structural studies of Cs-K-Bi mixed chlorides relation to the crystal structures of A~2~ B M X~6~, A~3~ M X~6~ and A~2~ M X~6~ Journal of Solid State Chemistry 65 (1986) 13-26

130,149

2020-10-21

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1,004,083

25.653

0.013

7.799

0.005

12.874

0.009

90

null

99.24

0.08

90

null

2,542.3

null

4

C 1 2/c 1

-C 2yc

15

Caesium dipotassium bismuth hexachloride

- Bi Cl6 Cs K2 -

- Bi8 Cl48 Cs8 K16 -

8

1

Benachenhou, F; Mairesse, G; Nowogrocki, G; Thomas, D

Structural studies of Cs-K-Bi mixed chlorides relation to the crystal structures of A~2~ B M X~6~, A~3~ M X~6~ and A~2~ M X~6~

Journal of Solid State Chemistry

1,986

65

13

26

10.1016/0022-4596(86)90085-X

null

0.044

null

has coordinates

Benachenhou, F; Mairesse, G; Nowogrocki, G; Thomas, D Structural studies of Cs-K-Bi mixed chlorides relation to the crystal structures of A~2~ B M X~6~, A~3~ M X~6~ and A~2~ M X~6~ Journal of Solid State Chemistry 65 (1986) 13-26

130,149

2020-10-21

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1,004,084

9.115

0.004

7.941

0.004

6.306

0.004

90

null

90

null

90

null

456.4

null

3

P b a m

-P 2 2ab

55

Dilead platinum oxide

- O4 Pb2 Pt -

- O16 Pb8 Pt4 -

4

0.5

Bettahar, N; Conflant, P; Abraham, F; Thomas, D

Pb~2~ Pt O~4~. A new platinum-lead oxide with edge-shared Pt O~6~ octahedral chains

Journal of Solid State Chemistry

1,987

67

85

90

10.1016/0022-4596(87)90342-2

null

0.049

null

has coordinates

Bettahar, N; Conflant, P; Abraham, F; Thomas, D Pb~2~ Pt O~4~. A new platinum-lead oxide with edge-shared Pt O~6~ octahedral chains Journal of Solid State Chemistry 67 (1987) 85-90

130,149

2020-10-21

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1,004,085

10.9431

null

10.9431

null

10.9431

null

90

null

90

null

90

null

1,310.5

null

4

F d -3 m :2

-F 4vw 2vw 3

227

Potassium bismuth(III) bismuth(V) oxide dideuteriohydrate (1.17/.51/1.79/5.87/1.11) - phase II

- Bi2.33 D K1.17 O6.5 -

- Bi2.33 D0.96 K1.17 O6.59 -

- Bi18.64 D7.68 K9.36 O52.72 -

8

0.041667

Trehoux, J; Abraham, F; Thomas, D; Doremieuz-Morin, C; Arribart, H

Neutron Diffraction and ^1^H Rigid Lattice Wide-Line NMR Studies of Powder (K, Bi^III^, Bi^V^) Pyrochlores

Journal of Solid State Chemistry

1,988

73

80

91

10.1016/0022-4596(88)90057-6

null

0.068

null

has coordinates

Trehoux, J; Abraham, F; Thomas, D; Doremieuz-Morin, C; Arribart, H Neutron Diffraction and ^1^H Rigid Lattice Wide-Line NMR Studies of Powder (K, Bi^III^, Bi^V^) Pyrochlores Journal of Solid State Chemistry 73 (1988) 80-91

176,435

2020-10-21

18:00:00

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1,004,086

4.101

0.004

4.101

0.004

6.066

0.004

90

null

90

null

120

null

88.4

null

4

P -3 m 1

-P 3 2"

164

Bismuth lead oxyfluoride

- Bi F O2 Pb -

- Bi F1.002 O1.998 Pb -

1

0.083333

Follet Houttemane, C; Canonne, J; Boivin, J C; Champarnaud Mesjard, J C; Mercurio, D; Frit, B

Electrical Properties and High Temperature Crystal Structure of the Bismuth Lead Oxyfluoride: Bi Pb O~2~ F

Solid State Ionics

1,988

28

458

464

null

0.039

null

has coordinates

Follet Houttemane, C; Canonne, J; Boivin, J C; Champarnaud Mesjard, J C; Mercurio, D; Frit, B Electrical Properties and High Temperature Crystal Structure of the Bismuth Lead Oxyfluoride: Bi Pb O~2~ F Solid State Ionics 28 (1988) 458-464

130,149

2020-10-21

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7,205,923

5.799

0.002

7.477

0.003

18.493

0.007

89.639

0.006

85.173

0.006

83.485

0.007

793.8

0.5

298

2

298

2

null

4

P -1

-P 1

2

Manganese anthraquinone-2,3-dicarboxylate

- C16 H14 Mn O10 -

- C32 H28 Mn2 O20 -

2

1

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.

Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks

Journal of Materials Chemistry

2,011

21

18

6595

10.1039/c0jm03907a

0.71073

MoKα

0.1359

0.0806

null

0.1826

0.2093

null

1.041

null

has coordinates

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K. Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks Journal of Materials Chemistry 21(18) (2011) 6595

180,390

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-03-26 17:22:32 +0200 (Sat, 26 Mar 2016) $ #$Revision: 180390 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205923.cif $ #-------------------------------------------------------------------...

1,004,087

4.04

0.002

4.04

0.002

27.557

0.007

90

null

90

null

120

null

389.5

null

3

R -3 m :H

-R 3 2"

166

Bismuth lanthanum oxide (0.7/0.3/1.38)

- Bi0.7 La0.3 O1.38 -

- Bi6.3 La2.7 O12.42 -

9

0.25

Mercurio, D; El Farissi, M; Champarnaud Mesjard, J C; Frit, B; Conflant, P; Roult, G

Etude structurale par diffraction X sur monocristal et diffraction neutronique sur poudre de l'oxyde mixte Bi~.7~ La~.3~ O~1.5~

Journal of Solid State Chemistry

1,989

80

133

143

10.1016/0022-4596(89)90040-6

null

0.042

null

has coordinates

Mercurio, D; El Farissi, M; Champarnaud Mesjard, J C; Frit, B; Conflant, P; Roult, G Etude structurale par diffraction X sur monocristal et diffraction neutronique sur poudre de l'oxyde mixte Bi~.7~ La~.3~ O~1.5~ Journal of Solid State Chemistry 80 (1989) 133-143

176,435

2020-10-21

18:00:00

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1,004,088

4.04

0.002

4.04

0.002

27.557

0.007

90

null

90

null

120

null

389.5

null

3

R -3 m :H

-R 3 2"

166

Bismuth lanthanum oxide (0.7/0.3/1.5)

- Bi0.7 La0.3 O1.5 -

- Bi0.7 La0.3 O1.51333 -

- Bi6.3 La2.7 O13.62 -

9

0.25

Mercurio, D; El Farissi, M; Champarnaud Mesjard, J C; Frit, B; Conflant, P; Roult, G

Etude structurale par diffraction X sur monocristal et diffraction neutronique sur poudre de l'oxyde mixte Bi~.7~ La~.3~ O~1.5~

Journal of Solid State Chemistry

1,989

80

133

143

10.1016/0022-4596(89)90040-6

null

has coordinates

Mercurio, D; El Farissi, M; Champarnaud Mesjard, J C; Frit, B; Conflant, P; Roult, G Etude structurale par diffraction X sur monocristal et diffraction neutronique sur poudre de l'oxyde mixte Bi~.7~ La~.3~ O~1.5~ Journal of Solid State Chemistry 80 (1989) 133-143

176,435

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004088.cif $ #-------------------------------------------------------------------...

1,004,089

10.176

null

10.176

null

10.176

null

90

null

90

null

90

null

1,053.7

null

3

F d -3 m :2

-F 4vw 2vw 3

227

Rubidium tungsten oxide (1/1.6/6) - III

- O6 Rb W1.6 -

- O48 Rb8 W12.8 -

8

0.041667

Driouiche, A; Abraham, F; Touboul, M; Figlarz, M

Synthesis and characterization of cubic pyrochlore-type rubidium and caesium tungstates with a lacunar host lattice

Materials Research Bulletin

1,991

26

901

908

10.1016/0025-5408(91)90170-Q

null

0.03

null

has coordinates

Driouiche, A; Abraham, F; Touboul, M; Figlarz, M Synthesis and characterization of cubic pyrochlore-type rubidium and caesium tungstates with a lacunar host lattice Materials Research Bulletin 26 (1991) 901-908

176,729

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004089.cif $ #-------------------------------------------------------------------...

7,205,922

5.8534

0.0017

7.504

0.002

18.599

0.005

91.1

0.02

95.03

0.02

95.97

0.02

809.1

0.4

298.1

null

298.1

null

4

P -1

-P 1

2

Cadmium anthraquinone-2,3-dicarboxylate

- C16 H14 Cd O10 -

- C32 H28 Cd2 O20 -

2

1

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.

Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks

Journal of Materials Chemistry

2,011

21

18

6595

10.1039/c0jm03907a

0.7107

MoKα

0.0775

0.05

null

0.1302

0.1659

null

1.093

null

has coordinates

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K. Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks Journal of Materials Chemistry 21(18) (2011) 6595

180,390

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-03-26 17:22:32 +0200 (Sat, 26 Mar 2016) $ #$Revision: 180390 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205922.cif $ #-------------------------------------------------------------------...

1,004,090

10.213

null

10.213

null

10.213

null

90

null

90

null

90

null

1,065.3

null

3

F d -3 m :2

-F 4vw 2vw 3

227

Caesium tungsten oxide (1/1.6/6) - III

- Cs O6 W1.6 -

- Cs8 O48 W12.8 -

8

0.041667

Driouiche, A; Abraham, F; Touboul, M; Figlarz, M

Synthesis and characterization of cubic pyrochlore-type rubidium and caesium tungstates with a lacunar host lattice

Materials Research Bulletin

1,991

26

901

908

10.1016/0025-5408(91)90170-Q

null

0.031

null

has coordinates

Driouiche, A; Abraham, F; Touboul, M; Figlarz, M Synthesis and characterization of cubic pyrochlore-type rubidium and caesium tungstates with a lacunar host lattice Materials Research Bulletin 26 (1991) 901-908

176,729

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004090.cif $ #-------------------------------------------------------------------...

1,004,091

19.86

0.01

5.353

0.006

13.96

0.03

90

null

110.64

0.07

90

null

1,388.8

null

4

P 1 21/c 1

-P 2ybc

14

Trisodium bismuth bis(phosphate) - $-alpha

- Bi Na3 O8 P2 -

- Bi8 Na24 O64 P16 -

8

2

Mairesse, G; Drache, M; Nowogrocki, G; Abraham, F

Order-disorder transition in Na~3~Bi(PO~4~)~2~

Phase Transition

1,990

27

91

105

10.1080/01411599008206903

null

0.069

null

has coordinates

Mairesse, G; Drache, M; Nowogrocki, G; Abraham, F Order-disorder transition in Na~3~Bi(PO~4~)~2~ Phase Transition 27 (1990) 91-105

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004091.cif $ #-------------------------------------------------------------------...

1,004,092

18.71

0.03

7.18

0.02

5.429

0.007

90

null

90

7

90

null

729.3

null

4

P n a m

-P 2c 2n

62

Trisodium bismuth bis(phosphate) - $-beta

- Bi Na3 O8 P2 -

- Bi4 Na12 O32 P8 -

4

0.5

Mairesse, G; Drache, M; Nowogrocki, G; Abraham, F

Order-disorder transition in Na~3~Bi(PO~4~)~2~

Phase Transition

1,990

27

91

105

10.1080/01411599008206903

null

0.055

null

has coordinates

Mairesse, G; Drache, M; Nowogrocki, G; Abraham, F Order-disorder transition in Na~3~Bi(PO~4~)~2~ Phase Transition 27 (1990) 91-105

130,149

2020-10-21

18:00:00

#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/40/1004092.cif $ #-------------------------------------------------------------------...

1,004,093

19.469

0.004

12.53

0.004

12.07

0.004

90

null

90

null

90

null

2,944.4

null

4

P 21 21 2

P 2 2ab

18

Ammonium hexaperthiodimolybdate(V)

- H8 Mo2 N2 S12 -

- H48 Mo12 N12 S72 -

6

1.5

Wignacourt, J P; Drache, M; Swinnea, J S; Steinfink, H; Lorriaux-Rubbens, A; Wallart, F

Crystal structure and Raman Scattering Investigation of Anhydrous (NH~4~)~2~(Mo~2~(S~2~)~6~)

Canadian Journal of Appl. Spectrosc.

1,992

37

2

49

54

null

0.058

null

has coordinates

Wignacourt, J P; Drache, M; Swinnea, J S; Steinfink, H; Lorriaux-Rubbens, A; Wallart, F Crystal structure and Raman Scattering Investigation of Anhydrous (NH~4~)~2~(Mo~2~(S~2~)~6~) Canadian Journal of Appl. Spectrosc. 37(2) (1992) 49-54

130,149

2020-10-21

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1,004,094

10.169

0.001

10.169

0.002

10.169

0.002

90

null

90

null

90

null

1,051.6

null

3

I 2 3

I 2 2 3

197

Bismuth(III) bismuth(V) phosphorus oxide (9.9/1.2/.9/20)

- Bi11.095 O20 P0.853 -

- Bi11.0952 O20 P0.853 -

- Bi22.1904 O40 P1.706 -

2

0.083333

Wignacourt, J P; Drache, M; Conflant, P; Boivin, J C

Nouvelles phases du systeme Bi~2~O~3~-BiPO~4~ . II.Structure et proprietes electriques d'une solution solide de type sillenite

Journal de Chimie Physique et de Physico-Chimie Biologique

1,991

88

1939

1949

null

0.029

null

has coordinates

Wignacourt, J P; Drache, M; Conflant, P; Boivin, J C Nouvelles phases du systeme Bi~2~O~3~-BiPO~4~ . II.Structure et proprietes electriques d'une solution solide de type sillenite Journal de Chimie Physique et de Physico-Chimie Biologique 88 (1991) 1939-1949

176,435

2020-10-21

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7,205,921

5.8133

0.0001

7.4885

0.0002

18.6076

0.0006

90.404

0.001

95.523

0.002

95.088

0.002

803.01

0.04

120

null

120

2

null

4

P -1

-P 1

2

Cadmium anthraquinone-2,3-dicarboxylate

- C16 H14 Cd O10 -

- C32 H28 Cd2 O20 -

2

1

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.

Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks

Journal of Materials Chemistry

2,011

21

18

6595

10.1039/c0jm03907a

0.71073

MoKα

0.0524

0.0515

null

0.1409

0.1425

null

1.082

null

has coordinates

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K. Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks Journal of Materials Chemistry 21(18) (2011) 6595

180,390

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1,004,095

16.563

0.007

16.563

0.007

18.563

0.006

90

null

90

null

90

null

5,092.4

null

5

I 4 m m

I 4 -2

107

Potassium hexabromoindate sesquihydrate

- Br6 H3 In K3 O1.5 -

- Br84 H42 In14 K42 O21 -

14

0.875

Lornaux-Rubbens, A; Wignacourt, J P; Drache, M; Wallart, F

Investigations structurales des composes K~3-x~(InX~6- x~(H~2~O)~x~,nH~2~O). I. Etude cristallographique (X=Br); comparaison des distances indium-ligand (X=Cl,Br)

Journal de Chimie Physique et de Physico-Chimie Biologique

1,991

88

2041

2055

null

0.075

null

has coordinates

Lornaux-Rubbens, A; Wignacourt, J P; Drache, M; Wallart, F Investigations structurales des composes K~3-x~(InX~6- x~(H~2~O)~x~,nH~2~O). I. Etude cristallographique (X=Br); comparaison des distances indium-ligand (X=Cl,Br) Journal de Chimie Physique et de Physico-Chimie Biologique 88 (1991) 2041-2055

176,435

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1,004,096

14.509

0.006

10.369

0.007

7.59

0.003

90

null

90

null

90

null

1,141.9

null

5

P n m a

-P 2ac 2n

62

Potassium pentabromoindate hydrate

- Br5 H2 In K2 O -

- Br20 H8 In4 K8 O4 -

4

0.5

Lornaux-Rubbens, A; Wignacourt, J P; Drache, M; Wallart, F

Investigations structurales des composes K~3-x~(InX~6- x~(H~2~O)~x~,nH~2~O). I. Etude cristallographique (X=Br); comparaison des distances indium-ligand (X=Cl,Br)

Journal de Chimie Physique et de Physico-Chimie Biologique

1,991

88

2041

2055

null

0.058

null

has coordinates

Lornaux-Rubbens, A; Wignacourt, J P; Drache, M; Wallart, F Investigations structurales des composes K~3-x~(InX~6- x~(H~2~O)~x~,nH~2~O). I. Etude cristallographique (X=Br); comparaison des distances indium-ligand (X=Cl,Br) Journal de Chimie Physique et de Physico-Chimie Biologique 88 (1991) 2041-2055

200,452

2020-10-21

18:00:00

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1,004,097

3.965

0.003

3.965

0.003

15.46

0.01

90

null

90

null

90

null

243.1

null

4

I 4/m m m

-I 4 2

139

Bismuth lead vanadium oxide (1.9/0.2/0.9/5.3)

- Bi1.9 O5.3 Pb0.2 V0.9 -

- Bi1.9004 O5.3 Pb0.2004 V0.9 -

- Bi3.8008 O10.6 Pb0.4008 V1.8 -

2

0.0625

Vannier, R N; Mairesse, G; Nowogrocki, G; Abraham, F; Boivin, J C

Electrical and structural investigations on a new bismuth lead vanadium oxide solid electrolyte

Solid State Ionics

1,992

53

713

722

null

0.042

null

has coordinates

Vannier, R N; Mairesse, G; Nowogrocki, G; Abraham, F; Boivin, J C Electrical and structural investigations on a new bismuth lead vanadium oxide solid electrolyte Solid State Ionics 53 (1992) 713-722

176,435

2020-10-21

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1,004,098

15.723

0.009

15.723

0.009

18.069

0.018

90

null

90

null

90

null

4,466.9

null

5

I 4 m m

I 4 -2

107

Potassium hexachloroindate hydrate

- Cl6 H2 In K3 O -

- Cl84 H28 In14 K42 O14 -

14

0.875

Wignacourt, J - P; Nowogrocki, G; Mairesse, G; Barbier, P

Evidence for ionic isomerism in complex salts. X-ray evidence in K~3~InCl~6~.H~2~O

Reviews in Inorganic Chemistry

1,980

2

207

217

null

0.029

null

has coordinates

Wignacourt, J - P; Nowogrocki, G; Mairesse, G; Barbier, P Evidence for ionic isomerism in complex salts. X-ray evidence in K~3~InCl~6~.H~2~O Reviews in Inorganic Chemistry 2 (1980) 207-217

176,435

2020-10-21

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7,205,920

5.96

0.002

7.634

0.003

18.603

0.007

90.145

0.006

95.804

0.006

97.105

0.006

835.5

0.5

293

2

293

2

null

4

P -1

-P 1

2

- C16 H14 Ca O10 -

- C32 H28 Ca2 O20 -

2

1

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K.

Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks

Journal of Materials Chemistry

2,011

21

18

6595

10.1039/c0jm03907a

0.71073

MoKα

0.0885

0.0509

null

0.0915

0.1015

null

0.912

null

has coordinates

Furman, Joshua D.; Burwood, Ryan P.; Tang, Min; Mikhailovsky, Alexander A.; Cheetham, Anthony K. Understanding ligand-centred photoluminescence through flexibility and bonding of anthraquinone inorganic‒organic frameworks Journal of Materials Chemistry 21(18) (2011) 6595

180,390

2020-10-21

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1,004,099

4.3223

0.0005

4.3223

0.0005

4.3223

0.0005

90

null

90

null

90

null

80.8

null

4

P m -3 m

-P 4 2 3

221

Barium potassium bismuth trioxide (0.87/0.13/1/1)

- Ba0.87 Bi K0.13 O3 -

1

0.020833

Wignacourt, J P; Swinnea, J S; Steinfink, H; Goodenough, J B

Oxygen atom thermal vibration anisotropy in Ba~0.87~ K~0.13~ Bi O~3~.

Applied Physics Letters

1,988

53

1753

1755

10.1063/1.100430

null

0.0089

null

has coordinates

Wignacourt, J P; Swinnea, J S; Steinfink, H; Goodenough, J B Oxygen atom thermal vibration anisotropy in Ba~0.87~ K~0.13~ Bi O~3~. Applied Physics Letters 53 (1988) 1753-1755

176,435

2020-10-21

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1,004,100

5.468

0.001

6.667

0.001

9.156

0.001

110.58

0.01

100.87

0.01

98.01

0.01

299.1

null

4

P -1

-P 1

2

Strontium dinickel phosphate

- Ni2 O8 P2 Sr -

- Ni4 O16 P4 Sr2 -

2

1

Elbali, B; Boukhari, A; Aride, J; Abraham, F

The crystal structure of SrNi~2~(PO4/4)~2~

Journal of Solid State Chemistry

1,993

104

453

459

10.1006/jssc.1993.1180

null

0.032

null

has coordinates

Elbali, B; Boukhari, A; Aride, J; Abraham, F The crystal structure of SrNi~2~(PO4/4)~2~ Journal of Solid State Chemistry 104 (1993) 453-459

130,149

2020-10-21

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1,004,101

3.97

null

3.97

null

28.53999

null

90

null

90

null

120

null

389.6

null

3

R -3 m :H

-R 3 2"

166

Bismuth strontium oxide (0.75/0.25/1.4) - $-beta~2~

- Bi0.75 O1.36 Sr0.25 -

- Bi0.75 O1.35567 Sr0.25 -

- Bi6.75 O12.201 Sr2.25 -

9

0.25

Mercurio, D; Champarnaud-Mesjard, J C; Frit, B; Conflant, P; Boivin, J C; Vogt, T

Thermal evolution of the crystal structure of the rhombohedral Bi~0.75~Sr~0.25~O~1.375~ phase: a single crystal neutron diffraction study

Journal of Solid State Chemistry

1,994

112

1

8

10.1006/jssc.1994.1255

null

0.024

null

has coordinates

Mercurio, D; Champarnaud-Mesjard, J C; Frit, B; Conflant, P; Boivin, J C; Vogt, T Thermal evolution of the crystal structure of the rhombohedral Bi~0.75~Sr~0.25~O~1.375~ phase: a single crystal neutron diffraction study Journal of Solid State Chemistry 112 (1994) 1-8

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1,004,102

3.983

null

3.983

null

28.68999

null

90

null

90

null

120

null

394.2

null

3

R -3 m :H

-R 3 2"

166

Bismuth strontium oxide (0.75/0.25/1.4) - $-beta~2~

- Bi0.75 O1.36 Sr0.25 -

- Bi0.75 O1.35553 Sr0.25 -

- Bi6.75 O12.1998 Sr2.25 -

9

0.25

Mercurio, D; Champarnaud-Mesjard, J C; Frit, B; Conflant, P; Boivin, J C; Vogt, T

Thermal evolution of the crystal structure of the rhombohedral Bi~0.75~Sr~0.25~O~1.375~ phase: a single crystal neutron diffraction study

Journal of Solid State Chemistry

1,994

112

1

8

10.1006/jssc.1994.1255

null

0.038

null

has coordinates

Mercurio, D; Champarnaud-Mesjard, J C; Frit, B; Conflant, P; Boivin, J C; Vogt, T Thermal evolution of the crystal structure of the rhombohedral Bi~0.75~Sr~0.25~O~1.375~ phase: a single crystal neutron diffraction study Journal of Solid State Chemistry 112 (1994) 1-8

176,435

2020-10-21

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7,205,919

6.8239

0.0004

7.2324

0.0003

35.2082

0.0015

90

null

90

null

90

null

1,737.64

0.15

173

2

173

2

null

3

P b c a

-P 2ac 2ab

61

- C24 H16 N2 -

- C96 H64 N8 -

4

0.5

Yoon, Seong-Jun; Park, SooYoung

Polymorphic and mechanochromic luminescence modulation in the highly emissive dicyanodistyrylbenzene crystal: secondary bonding interaction in molecular stacking assembly

Journal of Materials Chemistry

2,011

21

23

8338

10.1039/c0jm03711g

0.71073

MoKα

0.0665

0.0461

null

0.1319

0.1538

null

1.14

null

has coordinates

Yoon, Seong-Jun; Park, SooYoung Polymorphic and mechanochromic luminescence modulation in the highly emissive dicyanodistyrylbenzene crystal: secondary bonding interaction in molecular stacking assembly Journal of Materials Chemistry 21(23) (2011) 8338

301,863

2025-08-22

13:07:26

#------------------------------------------------------------------------------ #$Date: 2025-08-22 15:50:14 +0300 (Fri, 22 Aug 2025) $ #$Revision: 301863 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205919.cif $ #-------------------------------------------------------------------...

1,004,103

4.011

null

4.011

null

29.00999

null

90

null

90

null

120

null

404.2

null

3

R -3 m :H

-R 3 2"

166

Bismuth strontium oxide (0.75/0.25/1.4) - $-beta~1~

- Bi0.75 O1.37 Sr0.25 -

- Bi0.75 O1.3668 Sr0.25 -

- Bi6.75 O12.3012 Sr2.25 -

9

0.25

Mercurio, D; Champarnaud-Mesjard, J C; Frit, B; Conflant, P; Boivin, J C; Vogt, T

Thermal evolution of the crystal structure of the rhombohedral Bi~0.75~Sr~0.25~O~1.375~ phase: a single crystal neutron diffraction study

Journal of Solid State Chemistry

1,994

112

1

8

10.1006/jssc.1994.1255

null

0.043

null

has coordinates

Mercurio, D; Champarnaud-Mesjard, J C; Frit, B; Conflant, P; Boivin, J C; Vogt, T Thermal evolution of the crystal structure of the rhombohedral Bi~0.75~Sr~0.25~O~1.375~ phase: a single crystal neutron diffraction study Journal of Solid State Chemistry 112 (1994) 1-8

176,435

2020-10-21

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1,004,104

9.93

0.004

9.93

0.004

2.914

0.001

90

null

90

null

90

null

287.3

null

3

I 4/m

-I 4

87

Bismuth vanadium oxide (1.7/8/16)

- Bi1.62 O16 V8 -

- Bi1.624 O16 V8 -

1

0.0625

Abraham, F; Mentre, O

Bi~1.7~V~8~O~16~ The first Bi-hollandite-type compound

Journal of Solid State Chemistry

1,994

109

127

133

10.1006/jssc.1994.1082

null

0.022

null

has coordinates

Abraham, F; Mentre, O Bi~1.7~V~8~O~16~ The first Bi-hollandite-type compound Journal of Solid State Chemistry 109 (1994) 127-133

130,149

2020-10-21

18:00:00

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1,004,105

11.776

0.001

5.173

0.0006

7.7903

0.0006

90

null

90

null

90

null

474.6

null

4

P n m a

-P 2ac 2n

62

Bismuth dicopper phosphate(V) dioxide

- Bi Cu2 O6 P -

- Bi4 Cu8 O24 P4 -

4

0.5

Abraham, F; Ketatni, M; Mairesse, G; Mernari, B

Crystal structure of a new bismuth copper oxyphosphate: Bi Cu2 P O6

European Journal of Solid State Inorganic Chemistry

1,994

31

313

323

null

0.029

null

has coordinates

Abraham, F; Ketatni, M; Mairesse, G; Mernari, B Crystal structure of a new bismuth copper oxyphosphate: Bi Cu2 P O6 European Journal of Solid State Inorganic Chemistry 31 (1994) 313-323

130,149

2020-10-21

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1,004,106

5.312

0.001

8.789

0.002

16.06699

0.003

90

null

90.72

0.01

90

null

750.1

null

4

P 1 21/n 1

-P 2yn

14

Dibarium nickel bis(phosphate(V))

- Ba2 Ni O8 P2 -

- Ba8 Ni4 O32 P8 -

4

1

Elbali, B; Boukhari, A; Aride, J; Belaiche, M; Abraham, F; Drillon, M

Crystal structure and magnetic properties of Ba2 Ni (P O4)2

European Journal of Solid State Inorganic Chemistry

1,994

31

61

73

null

0.031

null

has coordinates

Elbali, B; Boukhari, A; Aride, J; Belaiche, M; Abraham, F; Drillon, M Crystal structure and magnetic properties of Ba2 Ni (P O4)2 European Journal of Solid State Inorganic Chemistry 31 (1994) 61-73

130,149

2020-10-21

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7,205,918

7.5492

0.0004

10.4571

0.0005

10.9153

0.0005

90

null

110.806

0.005

90

null

805.49

0.07

298

null

4

P 1 21/c 1

-P 2ybc

14

- N2 O7 Si2 Y4 -

- N2.0002 O6.9998 Si2 Y4 -

- N8.0008 O27.9992 Si8 Y16 -

4

1

Park, Woon Bae; Singh, Satendra Pal; Pyo, Myoungho; Sohn, Kee-Sun

Y6+x/3Si11−yAlyN20+x−yO1−x+y:Re3+ (Re = Ce3+, Tb3+, Sm3+) phosphors identified by solid-state combinatorial chemistry

Journal of Materials Chemistry

2,011

21

15

5780

10.1039/c0jm03538f

powder diffraction

1.5493

Synchrotron

null

9.3016

null

has coordinates

Park, Woon Bae; Singh, Satendra Pal; Pyo, Myoungho; Sohn, Kee-Sun Y6+x/3Si11−yAlyN20+x−yO1−x+y:Re3+ (Re = Ce3+, Tb3+, Sm3+) phosphors identified by solid-state combinatorial chemistry Journal of Materials Chemistry 21(15) (2011) 5780

180,390

2020-10-21

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#------------------------------------------------------------------------------ #$Date: 2016-03-26 17:22:32 +0200 (Sat, 26 Mar 2016) $ #$Revision: 180390 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/20/59/7205918.cif $ #-------------------------------------------------------------------...

1,004,107

5.6492

0.0001

13.1841

0.0002

7.2844

0.0001

90

null

119.745

0.001

90

null

471.1

null

3

P 1 21/c 1

-P 2ybc

14

Dioxouranium(VI) divanadate

- O11 U2 V2 -

- O22 U4 V4 -

2

0.5

Tancret, N; Obbade, S; Abraham, F

Ab initio structure determination of uranyl divanadate (U O2)2 V2 O7 from powder X-ray diffraction data

European Journal of Solid State Inorganic Chemistry

1,995

32

195

207

null

0.028

null

has coordinates

Tancret, N; Obbade, S; Abraham, F Ab initio structure determination of uranyl divanadate (U O2)2 V2 O7 from powder X-ray diffraction data European Journal of Solid State Inorganic Chemistry 32 (1995) 195-207

130,149

2020-10-21

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1,004,108

7.1664

0.0008

11.206

0.001

5.1732

0.0006

90

null

107.28

0.01

90

null

396.7

null

4

P 1 21/n 1

-P 2yn

14

Bismuth tecto-pentaoxoniccolophosphate(V)

- Bi Ni O5 P -

- Bi4 Ni4 O20 P4 -

4

1

Abraham, F; Ketatni, M

Crystal structure of a new bismuth nickel oxophosphate: Bi Ni O P O4

European Journal of Solid State Inorganic Chemistry

1,995

32

429

437

null

0.027

null

has coordinates

Abraham, F; Ketatni, M Crystal structure of a new bismuth nickel oxophosphate: Bi Ni O P O4 European Journal of Solid State Inorganic Chemistry 32 (1995) 429-437

130,149

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1,004,109

9.477

0.001

9.477

0.001

7.825

0.004

90

null

90

null

120

null

608.6

null

3

P 3 2 1

P 3 2"

150

Tetrastrontium nonaoxotriniccolate

- Ni3 O9 Sr4 -

- Ni9 O27 Sr12 -

3

0.5

Abraham, F; Minaud, S; Renard, C

Preliminary crystal structure of mixed-valency Sr4 Ni3 O9, the actual formula of the so-called Sr5 Ni4 O11

Journal of Materials Chemistry

1,994

4

11

1763

1764

10.1039/jm9940401763

null

0.045

null

has coordinates

Abraham, F; Minaud, S; Renard, C Preliminary crystal structure of mixed-valency Sr4 Ni3 O9, the actual formula of the so-called Sr5 Ni4 O11 Journal of Materials Chemistry 4(11) (1994) 1763-1764

130,149

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1,004,110

13.139

0.004

10.413

0.006

9.239

0.006

90

null

90

null

90

null

1,264

null

4

P n m a

-P 2ac 2n

62

Dipotassium tribismuth oxide tris(phosphate)

- Bi3 K2 O13 P3 -

- Bi12 K8 O52 P12 -

4

0.5

Debreuille-Gresse, M F; Drache, M; Abraham, F

The crystal structure, phase transition, and dielectric properties of K2 Bi3 (P O4)3 O, a new oxyphosphate

Journal of Solid State Chemistry

1,986

62

351

359

10.1016/0022-4596(86)90250-1

null

0.048

null

has coordinates

Debreuille-Gresse, M F; Drache, M; Abraham, F The crystal structure, phase transition, and dielectric properties of K2 Bi3 (P O4)3 O, a new oxyphosphate Journal of Solid State Chemistry 62 (1986) 351-359

130,149

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1,004,111

13.302

0.004

10.506

0.007

9.24

0.005

90

null

90

null

90

null

1,291.3

null

4

P n m a

-P 2ac 2n

62

Dipotassium tribismuth oxide tris(phosphate)

- Bi3 K2 O13 P3 -

- Bi12 K8 O52 P12 -

4

0.5

Debreuille-Gresse, M F; Drache, M; Abraham, F

The crystal structure, phase transition, and dielectric properties of K2 Bi3 (P O4)3 O, a new oxyphosphate

Journal of Solid State Chemistry

1,986

62

351

359

10.1016/0022-4596(86)90250-1

null

0.058

null

has coordinates

Debreuille-Gresse, M F; Drache, M; Abraham, F The crystal structure, phase transition, and dielectric properties of K2 Bi3 (P O4)3 O, a new oxyphosphate Journal of Solid State Chemistry 62 (1986) 351-359

130,149

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7,205,917

10.6431

0.0002

10.6431

0.0002

10.6431

0.0002

90

null

90

null

90

null

1,205.6

0.04

298

null

2

I a -3

-I 2b 2c 3

206

- O3 Y2 -

- O2.99994 Y1.99997 -

- O47.999 Y31.9995 -

16

0.333333

Park, Woon Bae; Singh, Satendra Pal; Pyo, Myoungho; Sohn, Kee-Sun

Y6+x/3Si11−yAlyN20+x−yO1−x+y:Re3+ (Re = Ce3+, Tb3+, Sm3+) phosphors identified by solid-state combinatorial chemistry

Journal of Materials Chemistry

2,011

21

15

5780

10.1039/c0jm03538f

powder diffraction

1.5493

Synchrotron

null

6.3456

null

has coordinates

Park, Woon Bae; Singh, Satendra Pal; Pyo, Myoungho; Sohn, Kee-Sun Y6+x/3Si11−yAlyN20+x−yO1−x+y:Re3+ (Re = Ce3+, Tb3+, Sm3+) phosphors identified by solid-state combinatorial chemistry Journal of Materials Chemistry 21(15) (2011) 5780

180,390

2020-10-21

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1,004,112

8.823

0.003

13.494

0.003

5.108

0.002

90

null

92.77

0.03

90

null

607.4

null

4

P 1 21/n 1

-P 2yn

14

Disodium copper diphosphate - $-alpha

- Cu Na2 O7 P2 -

- Cu4 Na8 O28 P8 -

4

1

Erragh, F; Boukhari, A; Abraham, F; Elouadi, B

The crystal structure of $-alpha- and $-beta- Na2 Cu P2 O7

Journal of Solid State Chemistry

1,995

120

23

31

10.1006/jssc.1995.1370

null

0.02

null

has coordinates

Erragh, F; Boukhari, A; Abraham, F; Elouadi, B The crystal structure of $-alpha- and $-beta- Na2 Cu P2 O7 Journal of Solid State Chemistry 120 (1995) 23-31

130,149

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