Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9007006 | CIF | Fe1.35 O3 Ti0.65 | R -3 :H | 5.13122; 5.13122; 14.0301 90; 90; 120 | 319.914 | Harrison, R. J.; Redfern, S. A. T. Short- and long-range ordering in the ilmenite-hematite solid solution Sample: ilm65, T = 893 C Physics and Chemistry of Minerals, 2001, 28, 399-412 |
| 9007007 | CIF | Fe1.35 O3 Ti0.65 | R -3 c :H | 5.13336; 5.13336; 14.0327 90; 90; 120 | 320.24 | Harrison, R. J.; Redfern, S. A. T. Short- and long-range ordering in the ilmenite-hematite solid solution Sample: ilm65, T = 918 C Physics and Chemistry of Minerals, 2001, 28, 399-412 |
| 9007008 | CIF | Fe1.35 O3 Ti0.65 | R -3 c :H | 5.1353; 5.1353; 14.0372 90; 90; 120 | 320.585 | Harrison, R. J.; Redfern, S. A. T. Short- and long-range ordering in the ilmenite-hematite solid solution Sample: ilm65, T = 945 C Physics and Chemistry of Minerals, 2001, 28, 399-412 |
| 9007009 | CIF | Fe1.35 O3 Ti0.65 | R -3 c :H | 5.13927; 5.13927; 14.0457 90; 90; 120 | 321.275 | Harrison, R. J.; Redfern, S. A. T. Short- and long-range ordering in the ilmenite-hematite solid solution Sample: ilm65, T = 994 C Physics and Chemistry of Minerals, 2001, 28, 399-412 |
| 9007010 | CIF | Fe1.35 O3 Ti0.65 | R -3 :H | 5.1322; 5.1322; 14.0317 90; 90; 120 | 320.072 | Harrison, R. J.; Redfern, S. A. T. Short- and long-range ordering in the ilmenite-hematite solid solution Sample: ilm65, T = 893 C Physics and Chemistry of Minerals, 2001, 28, 399-412 |
| 9007011 | CIF | Fe1.35 O3 Ti0.65 | R -3 :H | 5.12512; 5.12512; 14.0236 90; 90; 120 | 319.006 | Harrison, R. J.; Redfern, S. A. T. Short- and long-range ordering in the ilmenite-hematite solid solution Sample: ilm65, T = 793 C Physics and Chemistry of Minerals, 2001, 28, 399-412 |
| 9007012 | CIF | Fe1.35 O3 Ti0.65 | R -3 :H | 5.11249; 5.11249; 14.0019 90; 90; 120 | 316.944 | Harrison, R. J.; Redfern, S. A. T. Short- and long-range ordering in the ilmenite-hematite solid solution Sample: ilm65, T = 592 C Physics and Chemistry of Minerals, 2001, 28, 399-412 |
| 9007013 | CIF | C2 H2 Cu3 O8 | P 1 21/c 1 | 5.011; 5.85; 10.353 90; 92.41; 90 | 303.223 | Belokoneva, E. L.; Gubina, Y. K.; Forsyth, J. B. The charge density distribution and antiferromagnetic properties of azurite Cu3[CO3]2(OH)2 Note: O1 x-coordinate altered Physics and Chemistry of Minerals, 2001, 28, 498-507 |
| 9007014 | CIF | Al9 Ca3 Cl3 K3.36 Na5.64 O42 S1.5 Si9 | P 63 | 22.161; 22.161; 5.358 90; 90; 120 | 2278.83 | Bonaccorsi, E.; Merlino, S.; Pasero, M.; Macedonio, G. Microsommite: crystal chemistry, phase transitions, Ising model and Monte Carlo simulations Physics and Chemistry of Minerals, 2001, 28, 509-522 |
| 9007015 | CIF | Fe2.88 H5.83 K0.81 O13.64 S2 | R -3 m :H | 7.311; 7.311; 17.175 90; 90; 120 | 795.025 | Becker, U.; Gasharova, B. AFM observations and simulations of jarosite growth at the molecular scale: probing the basis for the incorporation of foreign ions into jarosite as a storage mineral Physics and Chemistry of Minerals, 2001, 28, 545-556 |
| 9007016 | CIF | Mg O3 Si | C 1 2/c 1 | 9.869; 9.059; 5.334 90; 109.91; 90 | 448.373 | Shimobayashi, N.; Miyake, A.; Kitamura, M.; Miura, E. Molecular dynamics simulations of the phase transition between low-temperature and high-temperature clinoenstatites Sample: from Smyth and Burnham, 1972 Physics and Chemistry of Minerals, 2001, 28, 591-599 |
| 9007017 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.09117; 8.09117; 8.09117 90; 90; 90 | 529.705 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 0 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007018 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.08843; 8.08843; 8.08843 90; 90; 90 | 529.167 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 0.3 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007019 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.08318; 8.08318; 8.08318 90; 90; 90 | 528.137 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 0.6 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007020 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.07922; 8.07922; 8.07922 90; 90; 90 | 527.361 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 0.8 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007021 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.07098; 8.07098; 8.07098 90; 90; 90 | 525.749 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 1.8 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007022 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.0629; 8.0629; 8.0629 90; 90; 90 | 524.172 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 2.2 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007023 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.0532; 8.0532; 8.0532 90; 90; 90 | 522.282 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 3.1 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007024 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.0334; 8.0334; 8.0334 90; 90; 90 | 518.44 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 4.6 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007025 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.01869; 8.01869; 8.01869 90; 90; 90 | 515.597 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 6.1 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007026 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.99606; 7.99606; 7.99606 90; 90; 90 | 511.244 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 8.3 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007027 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.97037; 7.97037; 7.97037 90; 90; 90 | 506.332 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 10.8 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007028 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.95609; 7.95609; 7.95609 90; 90; 90 | 503.615 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 12.4 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007029 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.94532; 7.94532; 7.94532 90; 90; 90 | 501.573 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 13.7 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007030 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.9364; 7.9364; 7.9364 90; 90; 90 | 499.886 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 14.5 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007031 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.92472; 7.92472; 7.92472 90; 90; 90 | 497.682 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 15.9 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007032 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.91769; 7.91769; 7.91769 90; 90; 90 | 496.359 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 16.7 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007033 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.909; 7.909; 7.909 90; 90; 90 | 494.726 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 17.7 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007034 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.9035; 7.9035; 7.9035 90; 90; 90 | 493.695 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 18.6 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007035 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.8909; 7.8909; 7.8909 90; 90; 90 | 491.337 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 19.9 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007036 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.8837; 7.8837; 7.8837 90; 90; 90 | 489.993 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 21.0 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007037 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.8769; 7.8769; 7.8769 90; 90; 90 | 488.727 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 21.9 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007038 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.8629; 7.8629; 7.8629 90; 90; 90 | 486.125 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 23.8 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007039 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.8523; 7.8523; 7.8523 90; 90; 90 | 484.162 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 25.4 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007040 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.8389; 7.8389; 7.8389 90; 90; 90 | 481.687 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 27.2 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007041 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.8231; 7.8231; 7.8231 90; 90; 90 | 478.781 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 29.8 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007042 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.8083; 7.8083; 7.8083 90; 90; 90 | 476.069 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 32.2 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007043 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.79; 7.79; 7.79 90; 90; 90 | 472.729 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 35.2 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007044 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.762; 7.762; 7.762 90; 90; 90 | 467.65 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 39.8 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 9007045 | CIF | Al2 O4 Zn | F d -3 m :2 | 7.7452; 7.7452; 7.7452 90; 90; 90 | 464.62 | Levy, D.; Pavese, A.; Sani, A.; Pischedda, V. Structure and compressibility of synthetic ZnAl2O4 (gahnite) under high-pressure conditions, from synchrotron X-ray powder diffraction Sample: P = 42.9 GPa Physics and Chemistry of Minerals, 2001, 28, 612-618 |
| 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 |
| 9009225 | CIF | Fe1.98 Mg0.854 O4 Re0.166 | F d -3 m :2 | 8.4158; 8.4158; 8.4158 90; 90; 90 | 596.055 | Righter, K.; Downs, R. T. The crystal structures of synthetic Re- and PGE-bearing magnesioferrite spinels: Implications for impacts, accretion and the mantle Sample: 111 Geophysical Research Letters, 2001, 28, 619-622 |
| 9009226 | CIF | Fe2.144 Mg0.78 O4 Re0.076 | F d -3 m :2 | 8.4055; 8.4055; 8.4055 90; 90; 90 | 593.869 | Righter, K.; Downs, R. T. The crystal structures of synthetic Re- and PGE-bearing magnesioferrite spinels: Implications for impacts, accretion and the mantle Sample: 116 Geophysical Research Letters, 2001, 28, 619-622 |
| 9009227 | CIF | Fe1.665 Ir0.042 Mg1.063 O4 Ru0.23 | F d -3 m :2 | 8.4034; 8.4034; 8.4034 90; 90; 90 | 593.424 | Righter, K.; Downs, R. T. The crystal structures of synthetic Re- and PGE-bearing magnesioferrite spinels: Implications for impacts, accretion and the mantle Sample: 115 Geophysical Research Letters, 2001, 28, 619-622 |
| 9009228 | CIF | Fe1.807 Mg1.039 O4 Os0.056 Rh0.1 | F d -3 m :2 | 8.3955; 8.3955; 8.3955 90; 90; 90 | 591.752 | Righter, K.; Downs, R. T. The crystal structures of synthetic Re- and PGE-bearing magnesioferrite spinels: Implications for impacts, accretion and the mantle Sample: 117 Geophysical Research Letters, 2001, 28, 619-622 |
| 9009604 | CIF | C4 H8 Al4 Ca2 Cl Na O20 | P 4/n m m :2 | 11.1983; 11.1983; 6.5637 90; 90; 90 | 823.101 | Effenberger, H.; Kluger, F.; Pertlik, F.; Zemann, J. Tunisit: kristallstruktur und revision der chemischen formel Tschermaks Mineralogische und Petrographische Mitteilungen, 1981, 28, 65-77 |
| 9009784 | CIF | As2 O3 | F d -3 m :1 | 11.074; 11.074; 11.074 90; 90; 90 | 1358.04 | Pertlik, F. Structure refinement of cubic As2O3 (arsenolithe) with single crystal data Czechoslovak Journal of Physics B, 1978, 28, 170-176 |
| 9011115 | CIF | K2 Mg5 O30 Si12 | P 6/m c c | 10.222; 10.222; 14.152 90; 90; 120 | 1280.62 | Khan, A. A.; Baur, W. H.; Forbes, W. C. Synthetic magnesian merrihueite, dipotassium pentamagnesium dodecasilicate: a tetrahedral magnesiosilicate framework crystal structure Acta Crystallographica, Section B, 1972, 28, 267-272 |
| 9011116 | CIF | Se8 | P 1 21/n 1 | 9.054; 9.083; 11.601 90; 90.81; 90 | 953.942 | Cherin, P.; Unger, P. Refinement of the crystal structure of alpha-monoclinic Se Sample: at T = 26 C Note: structure known as alpha phase Acta Crystallographica, Section B, 1972, 28, 313-317 |
| 9011117 | CIF | Ag5 Hg7.55 | I 2 3 | 10.0506; 10.0506; 10.0506 90; 90; 90 | 1015.26 | Fairhurst, C. W.; Cohen, J. B. The crystal structure of two compounds found in dental amalgam: Ag2Hg3 and Ag3Sn Acta Crystallographica, Section B, 1972, 28, 371-378 |
| 9011118 | CIF | Ag3 Sn | P m m n :2 | 5.968; 4.7802; 5.1843 90; 90; 90 | 147.899 | Fairhurst, C. W.; Cohen, J. B. The crystal structure of two compounds found in dental amalgam: Ag2Hg3 and Ag3Sn Acta Crystallographica, Section B, 1972, 28, 371-378 |
| 9011119 | CIF | C8 H5 N O2 | P 1 21/n 1 | 22.83; 7.651; 3.81 90; 91.36; 90 | 665.314 | Matzat, E. Die kristallstruktur des phtalimids (kladnoit) Acta Crystallographica, Section B, 1972, 28, 415-418 |
| 9011120 | CIF | Ga | C m c m | 10.593; 13.523; 5.203 90; 90; 90 | 745.325 | Bosio, L.; Curien, H.; Dupont, M.; Rimsky, A. Structure cristalline de Ga-gamma Sample: at T = 220 K Note: structure known as gamma phase Acta Crystallographica, Section B, 1972, 28, 1974-1975 |
| 9011121 | CIF | H9 N2 O4 P | P 1 21/c 1 | 11.043; 6.7; 8.031 90; 113.42; 90 | 545.246 | Khan, A. A.; Roux, J. P.; James, W. J. The crystal structure of diammonium hydrogen phosphate, (NH4)2HPO4 Acta Crystallographica, Section B, 1972, 28, 2065-2069 |
| 9011122 | CIF | H4 Mo O5 | P 1 21/n 1 | 10.476; 13.822; 10.606 90; 91.62; 90 | 1535.13 | Krebs, B. Die kristallstruktur von MoO3*2H2O Acta Crystallographica, Section B, 1972, 28, 2222-2231 |
| 9011123 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.035; 10.309; 3.795 90; 90; 90 | 314.351 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(XR) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011124 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.025; 10.3; 3.799 90; 90; 90 | 314.016 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(XR) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011125 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.027; 10.298; 3.816 90; 90; 90 | 315.438 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(XR) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011126 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.035; 10.309; 3.795 90; 90; 90 | 314.351 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(N) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011127 | CIF | C2 H2 N2 O5 | P 21 21 2 | 8.025; 10.3; 3.799 90; 90; 90 | 314.016 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(N) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011128 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.027; 10.298; 3.816 90; 90; 90 | 315.438 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(N) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011129 | CIF | Cl10 Cu4 K4 O | C 1 2/c 1 | 14.7; 14.88; 8.95 90; 104.74; 90 | 1893.26 | de Boer, J. J.; Bright, D.; Helle, J. N. The structure of the potassium salt of mu4-oxo-hexa-mu-chloro- tetra[chlorocuprate(II)], K4Cu4OCl10 Acta Crystallographica, Section B, 1972, 28, 3436-3437 |
| 9011130 | CIF | B5 H10 Na O13 | C 1 2/c 1 | 11.119; 16.474; 13.576 90; 112.83; 90 | 2291.96 | Merlino, S.; Sartori, F. The crystal structure of sborgite, NaB5O6(OH)4*3H2O Acta Crystallographica, Section B, 1972, 28, 3559-3567 |
| 9011131 | CIF | H0.886 O12.886 P3 Sr4.894 | P 63/m | 9.745; 9.745; 7.265 90; 90; 120 | 597.489 | Sudarsanan, K.; Young, R. A. Structure of strontium hydroxide phosphate, Sr5(PO4)3OH Locality: synthetic Acta Crystallographica, Section B, 1972, 28, 3668-3670 |
| 9011133 | CIF | Cu3 S4 Sb | I -4 2 m | 5.385; 5.385; 10.754 90; 90; 90 | 311.847 | Garin, J.; Parthe, E. The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4 Acta Crystallographica, Section B, 1972, 28, 3672-3674 |
| 9011134 | CIF | Cu3 P Se4 | P m n 21 | 7.697; 6.661; 6.381 90; 90; 90 | 327.152 | Garin, J.; Parthe, E. The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4 Acta Crystallographica, Section B, 1972, 28, 3672-3674 |
| 9011879 | CIF | Be2 Ca0.26 Fe0.065 H2 O10 Si2 Y1.02 Yb0.72 | P 1 21/a 1 | 9.888; 7.607; 4.74 90; 90.45; 90 | 356.522 | Yakubovich, O. V.; Matvienko, E. N.; Voloshin, A. V.; Simonov, M. A. The crystal structure of hingganite-(Yb), (Y0.51TR0.36Ca0.13)*Fe0.065Be[SiO4](OH) Locality: amazonite pegmatites, Kola peninsula, Russia Soviet Physics Crystallography, 1983, 28, 269-271 |
| 9011880 | CIF | B2 H6 Mg O7 | P 42 | 7.614; 7.614; 8.1898 90; 90; 90 | 474.787 | Genkina, E. A.; Malinovskii, Y. A. Refinement of the structure of pinnoite: Location of hydrogen atoms Soviet Physics Crystallography, 1983, 28, 475-477 |
| 9011904 | CIF | Ba0.667 Ca F0.667 Fe H0.667 K0.667 Mn0.5 Na O17.333 Si4 Sr0.667 Ti2.5 | C 1 2/m 1 | 19.431; 7.086; 5.392 90; 96.75; 90 | 737.268 | Saf'yanov, Y. N.; Vasil'eva, N. O.; Golovachev, V. P.; Kuz'min, E. A.; Belov, N. V. The crystal structure of lamprophyllite Soviet Physics Doklady, 1983, 28, 207-209 |
| 9011956 | CIF | Fe H11 O10 S | R -3 :H | 24.17699; 24.17699; 7.656 90; 90; 120 | 3875.58 | Scordari, F. Fibroferrite: A mineral with a {Fe(OH)(H2O)2SO4} spiral chain and its relationship to Fe(OH)SO4, butlerite and parabutlerite Locality: Saint Felix de Pailleres, France Tschermaks Mineralogische und Petrographische Mitteilungen, 1981, 28, 17-29 |
| 9011957 | CIF | Ca0.74 F Fe0.22 Mg0.01 Mn0.32 Na1.5 Nb0.14 O8 Si2 Ti0.16 Zr0.91 | P 1 21/a 1 | 10.83; 9.98; 7.174 90; 108.1; 90 | 737.021 | Mellini, M. Refinement of the crystal structure of lavenite Tschermaks Mineralogische und Petrographische Mitteilungen, 1981, 28, 99-112 |
| 9012064 | CIF | Bi2 Te3 | R -3 m :H | 4.395; 4.395; 30.44 90; 90; 120 | 509.205 | Feutelais, Y.; Legendre, B.; Rodier, N.; Agafonov, V. A study of the phases in the bismuth - tellurium system Materials Research Bulletin, 1993, 28, 591-596 |
| 9012138 | CIF | B | P 43 | 10.14; 10.14; 14.17 90; 90; 90 | 1456.95 | Vlasse, M.; Naslain, R.; Kasper, J. S.; Ploog, K. Crystal structure of tetragonal boron related to alpha AlB12 Locality: synthetic Journal of Solid State Chemistry, 1979, 28, 289-301 |
| 9012550 | CIF | As2 Fe | P n n m | 5.3012; 5.9858; 2.8822 90; 90; 90 | 91.458 | Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000 |
| 9012551 | CIF | Fe Se2 | P n n m | 4.8002; 5.7823; 3.5834 90; 90; 90 | 99.462 | Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000 |
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