Crystallography Open Database
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Searching journal of publication like 'Acta Crystallographica Section B'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9007535 | CIF | F2 Mn | P 42/m n m | 4.8738; 4.8738; 3.3107 90; 90; 90 | 78.642 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007536 | CIF | F2 Fe | P 42/m n m | 4.6945; 4.6945; 3.3097 90; 90; 90 | 72.94 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007537 | CIF | Co F2 | P 42/m n m | 4.6954; 4.6954; 3.1774 90; 90; 90 | 70.051 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007538 | CIF | F2 Ni | P 42/m n m | 4.6498; 4.6498; 3.0838 90; 90; 90 | 66.674 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007539 | CIF | F2 Zn | P 42/m n m | 4.7048; 4.7048; 3.1338 90; 90; 90 | 69.367 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007540 | CIF | Cr O2 | P 42/m n m | 4.421; 4.421; 2.917 90; 90; 90 | 57.013 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Cloud et al (1962) Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007541 | CIF | O2 Ru | P 42/m n m | 4.4919; 4.4919; 3.1066 90; 90; 90 | 62.682 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Boman (1970) Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007542 | CIF | O2 Os | P 42/m n m | 4.5003; 4.5003; 3.1839 90; 90; 90 | 64.483 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Boman (1970) Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007543 | CIF | O2 Pb | P 42/m n m | 4.9568; 4.9568; 3.3866 90; 90; 90 | 83.208 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Leciejewicz and Padlo (1962) Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007544 | CIF | As3 Co0.87 Fe0.11 Ni0.13 | I m -3 | 8.195; 8.195; 8.195 90; 90; 90 | 550.36 | Mandel, N.; Donohue, J. The refinement of the crystal structure of skutterudite, CoAs3 Acta Crystallographica, Section B, 1971, 27, 2288-2289 |
| 9007545 | CIF | As Ca H3 O5 | P c n b | 6.904; 16.161; 7.935 90; 90; 90 | 885.352 | Ferraris, G.; Jones, D. W.; Yerkess, J. A neutron and X-ray refinement of the crystal structure of CaHAsO4*H2O (haidingerite) Sample: neutron refinement Locality: synthetic Acta Crystallographica, Section B, 1972, 28, 209-214 |
| 9007546 | CIF | As Ca H2 O5 | P c n b | 6.904; 16.161; 7.935 90; 90; 90 | 885.352 | Ferraris, G.; Jones, D. W.; Yerkess, J. A neutron and X-ray refinement of the crystal structure of CaHAsO4*H2O (haidingerite) Sample: X-ray refinement Locality: synthetic Acta Crystallographica, Section B, 1972, 28, 209-214 |
| 9007547 | CIF | Cr H4 N Na O6 | P 21 21 21 | 8.413; 13.039; 6.219 90; 90; 90 | 682.206 | Khan, A. A.; Baur, W. H. Salt hydrates. VIII. The crystal structures of sodium ammonium orthochromate dihydrate and magnesium diammonium bis(hydrogen orthophosphate) tetrahydrate and a discussion of the ammonium ion Acta Crystallographica, Section B, 1972, 28, 683-693 |
| 9007548 | CIF | H10 Mg N2 O12 P2 | P b c a | 11.49; 23.66; 8.62 90; 90; 90 | 2343.38 | Khan, A. A.; Baur, W. H. Salt hydrates. VIII. The crystal structures of sodium ammonium orthochromate dihydrate and magnesium diammonium bis(hydrogen orthophosphate) tetrahydrate and a discussion of the ammonium ion Acta Crystallographica, Section B, 1972, 28, 683-693 |
| 9007549 | CIF | C H6 Mg O6 | P 1 21/n 1 | 7.7053; 5.3673; 12.1212 90; 90.451; 90 | 501.277 | Stephan, G. W.; MacGillavry, C. H. The crystal structure of nesquehonite, MgCO3*3H2O Acta Crystallographica, Section B, 1972, 28, 1031-1033 |
| 9007550 | CIF | Ca Cu4 H12 O17 S2 | P 1 21/c 1 | 20.87; 6.135; 22.191 90; 102.73; 90 | 2771.44 | Sabelli, C.; Zanazzi, P. F. The crystal structure of devillite Note: z-coordinate of Cu7 altered to match reported bond lengths Acta Crystallographica, Section B, 1972, 28, 1182-1189 |
| 9007551 | CIF | Ni5.629 S4.86 | B m m b | 3.274; 16.157; 11.359 90; 90; 90 | 600.869 | Fleet, M. E. The crystal structure of alpha-Ni7S6 Acta Crystallographica, Section B, 1972, 28, 1237-1241 |
| 9007552 | CIF | H10 Mg O9 S | P -1 | 6.314; 10.505; 6.03 81.12; 109.82; 105.08 | 362.347 | Baur, W. H.; Rolin, J. L. Salt hydrates. IX. The comparison of the crystal structure of magnesium sulfate pentahydrate with copper sulfate pentahydrate and magnesium chromate pentahydrate Locality: synthetic Acta Crystallographica, Section B, 1972, 28, 1448-1455 |
| 9007553 | CIF | F Mn2 O4 P | C 1 2/c 1 | 13.41; 6.5096; 10.094 90; 119.99; 90 | 763.169 | Rea, J. R.; Kostiner, E. The crystal structure of manganese fluorophosphate, Mn2(PO4)F Acta Crystallographica, Section B, 1972, 28, 2525-2529 |
| 9007554 | CIF | N Na O3 | R -3 c :H | 5.07; 5.07; 16.82 90; 90; 120 | 374.432 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 20 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007555 | CIF | N Na O3 | R -3 c :H | 5.074; 5.074; 16.97 90; 90; 120 | 378.367 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 100 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007556 | CIF | N Na O3 | R -3 c :H | 5.077; 5.077; 17.13 90; 90; 120 | 382.386 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 180 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007557 | CIF | N Na O3 | R -3 c :H | 5.079; 5.079; 17.23 90; 90; 120 | 384.922 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 230 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007558 | CIF | N Na O3 | R -3 c :H | 5.081; 5.081; 17.27 90; 90; 120 | 386.119 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 250 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007559 | CIF | N Na O3 | R -3 c :H | 5.082; 5.082; 17.31 90; 90; 120 | 387.166 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 268 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007560 | CIF | N Na O3 | R -3 m :H | 5.084; 5.084; 8.175 90; 90; 120 | 182.991 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 290 C Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007561 | CIF | N Na O3 | R -3 c :H | 5.07; 5.07; 16.82 90; 90; 120 | 374.432 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 20 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007562 | CIF | N Na O3 | R -3 c :H | 5.074; 5.074; 16.97 90; 90; 120 | 378.367 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 100 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007563 | CIF | N Na O3 | R -3 c :H | 5.077; 5.077; 17.13 90; 90; 120 | 382.386 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 180 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007564 | CIF | N Na O3 | R -3 c :H | 5.079; 5.079; 17.23 90; 90; 120 | 384.922 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 230 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007565 | CIF | N Na O3 | R -3 c :H | 5.081; 5.081; 17.27 90; 90; 120 | 386.119 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 250 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007566 | CIF | N Na O3 | R -3 c :H | 5.082; 5.082; 17.31 90; 90; 120 | 387.166 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 268 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007567 | CIF | N Na O3 | R -3 m :H | 5.084; 5.084; 8.175 90; 90; 120 | 182.991 | Paul, G. L.; Pryor, A. W. The study of sodium nitrate by neutron diffraction Sample: T = 290 C, refined incorporating curvilinear motion of O atom Acta Crystallographica, Section B, 1972, 28, 2700-2702 |
| 9007568 | CIF | Al0.7 Ca12.098 F8.4 H13 Mg0.1 Na0.102 O35.6 Si10 | R -3 :H | 9.36; 9.36; 36.48 90; 90; 120 | 2767.82 | Merlino, S. The crystal structure of zeophyllite Acta Crystallographica, Section B, 1972, 28, 2726-2732 |
| 9007569 | CIF | K2 O4 S | P n a m | 7.476; 10.071; 5.763 90; 90; 90 | 433.901 | McGinnety, J. A. Redetermination of the structures of potassium sulphate and potassium chromate: the effect of electrostatic crystal forces upon observed bond length Acta Crystallographica, Section B, 1972, 28, 2845-2852 |
| 9007570 | CIF | Cr K2 O4 | P n a m | 7.663; 10.388; 5.922 90; 90; 90 | 471.41 | McGinnety, J. A. Redetermination of the structures of potassium sulphate and potassium chromate: the effect of electrostatic crystal forces upon observed bond length Acta Crystallographica, Section B, 1972, 28, 2845-2852 |
| 9007571 | CIF | As H15 Mg O11 | C 1 2/c 1 | 6.6918; 25.744; 11.538 90; 95.15; 90 | 1979.67 | Ferraris, G.; Franchini-Angela M Hydrogen bonding in the crystalline state. Crystal structure of MgHAsO4*7H2O roesslerite Note: B(1,3) of O2 was altered to reproduce axial lengths Acta Crystallographica, Section B, 1973, 29, 286-292 |
| 9007572 | CIF | Cu Fe S2 | I -4 2 d | 5.289; 5.289; 10.423 90; 90; 90 | 291.568 | Hall, S. R.; Stewart, J. M. The crystal structure refinement of chalcopyrite, CuFeS2 Acta Crystallographica, Section B, 1973, 29, 579-585 |
| 9007573 | CIF | As H16 Mg N O10 | P m n 21 | 7.054; 6.205; 11.368 90; 90; 90 | 497.578 | Ferraris, G.; Franchini-Angela M Hydrogen bonding in the crystalline state. Refinement of the crystal structure of MgNH4AsO4*6(H2O), arsenstruvite Acta Crystallographica, Section B, 1973, 29, 859-863 |
| 9007574 | CIF | Ni0.5 Pd Pt2.5 S4 | P 42/m | 6.38; 6.38; 6.57 90; 90; 90 | 267.428 | Childs, J. D.; Hall, S. R. The crystal structure of braggite, (Pt,Pd,Ni)S Acta Crystallographica, Section B, 1973, 29, 1446-1451 |
| 9007575 | CIF | C H6 Cu2 O21 Pb5 S3 | P m n 21 | 20.089; 7.146; 6.56 90; 90; 90 | 941.727 | Giacovazzo, C.; Menchetti, S.; Scordari, F. The crystal structure of caledonite, Cu2Pb5(SO4)3CO3(OH)6 Acta Crystallographica, Section B, 1973, 29, 1986-1990 |
| 9007576 | CIF | Ba6 Cl4.6 Fe0.15 H0.5 Mn2.082 O19 Si6 Ti0.768 | P 6/m m m | 16.398; 16.398; 7.2 90; 90; 120 | 1676.66 | Kampf, A. R.; Khan, A. A.; Baur, W. H. Barium chloride silicate with an open framework: verplanckite Acta Crystallographica, Section B, 1973, 29, 2019-2021 |
| 9007577 | CIF | Al H4 O6 P | P 1 21/n 1 | 5.178; 9.514; 8.454 90; 90.35; 90 | 416.466 | Kniep, R.; Mootz, D. Metavariscite - A redetermination of its crystal structure Acta Crystallographica, Section B, 1973, 29, 2292-2294 |
| 9007578 | CIF | Bi Cu3 S3 | P 21 21 21 | 7.723; 10.395; 6.716 90; 90; 90 | 539.164 | Kocman, V.; Nuffield, E. W. The crystal structure of wittichenite, Cu3BiS3 Acta Crystallographica, Section B, 1973, 29, 2528-2535 |
| 9007579 | CIF | As S3 Sb | P 1 21/a 1 | 11.8568; 9.0152; 10.1938 90; 116.365; 90 | 976.29 | Guillermo, T. R.; Wuensch, B. J. The crystal structure of getchellite, AsSbS3 Acta Crystallographica, Section B, 1973, 29, 2536-2541 |
| 9007580 | CIF | H6 N O4 P | I -4 2 d | 7.4997; 7.4997; 7.5494 90; 90; 90 | 424.62 | Khan, A. A.; Baur, W. H. Refinement of the crystal structures of ammonium dihydrogen phosphate and ammonium dihydrogen arsenate Note: known as ADP Acta Crystallographica, Section B, 1973, 29, 2721-2726 |
| 9007581 | CIF | As H6 N O4 | I -4 2 d | 7.6998; 7.6998; 7.7158 90; 90; 90 | 457.446 | Khan, A. A.; Baur, W. H. Refinement of the crystal structures of ammonium dihydrogen phosphate and ammonium dihydrogen arsenate Note: known as ADA Acta Crystallographica, Section B, 1973, 29, 2721-2726 |
| 9007582 | CIF | H2 K O4 P | P 21 21 21 | 7.434; 7.434; 6.945 90; 90; 90 | 383.811 | Baur, W. H. Reconstruction of local atomic environments in the disordered hydrogen-bonded crystal structures of paraelectric ammonium dihydrogen phosphate and potassium dihydrogen phosphate Note: known as KDP Note: polymorph of archerite Acta Crystallographica, Section B, 1973, 29, 2726-2731 |
| 9007583 | CIF | H6 N O4 P | P 21 21 21 | 7.4997; 7.4997; 7.5493 90; 90; 90 | 424.614 | Baur, W. H. Reconstruction of local atomic environments in the disordered hydrogen-bonded crystal structures of paraelectric ammonium dihydrogen phosphate and potassium dihydrogen phosphate Note: polymorph of biphosphammite Acta Crystallographica, Section B, 1973, 29, 2726-2731 |
| 9007584 | CIF | H12 O16 S2 V2 | P 1 21/c 1 | 7.411; 7.439; 12.272 90; 108.9; 90 | 640.084 | Theobald, F.; Galy, J. Structure cristalline de VOSO4((H2O)3 Locality: synthetic Note: polymorph of bobjonesite Acta Crystallographica, Section B, 1973, 29, 2732-2736 |
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