Crystallography Open Database
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Searching space group like 'I 4/m'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7718474 | CIF | Al Ba F5 | I 4/m | 14.4398; 14.4398; 7.2843 90; 90; 90 | 1518.8 | Liu, Shaohua; Zhang, Lili; Li, Ke; Ma, Xiaotian; Long, Xifa; Yang, Yun Coordinated assembly of alkali and alkaline earth metals with the perfluorinated [AlF<sub>6</sub>] group to design deep-ultraviolet zero-order waveplate materials. Dalton transactions (Cambridge, England : 2003), 2025, 54, 7214-7220 |
| 7719301 | CIF | C168 H288 F36 Ge84 N68 O176 | I 4/m | 24.0248; 24.0248; 35.81 90; 90; 90 | 20669.2 | Li, Hao; Xu, Yanan; Zhang, Shiyue; Gu, Pengliang; Hu, Qing; Zhang, Yu; Wang, Wenkai; Shi, Zhan; Fu, Xinyi; Du, Hongbin Structure-directing synthesis of two germanate cages featuring odd-member ring windows. Dalton transactions (Cambridge, England : 2003), 2025, 54, 13775-13782 |
| 7719942 | CIF | C20 Cl Ir2 K3.4 O47.63 P W11 | I 4/m | 35.1781; 35.1781; 11.3965 90; 90; 90 | 14103.2 | Sugiarto, Sugiarto; Shinogi, Jun; Ebied, Sherif E.; Hong, Dachao; Kon, Yoshihiro; Sadakane, Masahiro Reaction of a Cp*Ir(III) Cation with mono-and di-lacunary Keggintype heterpolytungstates, and dimer of hexa-lacunary Dawsontype phosphopolytungstate Dalton Transactions, 2025 |
| 8101423 | CIF | Te4 Zr5 | I 4/m | 10.7656; 10.7656; 3.842 90; 90; 90 | 445.28 | Örlygsson, Gissur; Harbrecht, Bernd Crystal structure of pentazirconium tetratelluride, Zr~5~Te~4~ Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 5-6 |
| 8103389 | CIF | Ag Cl O3 | I 4/m | 7.486; 7.486; 7.89 90; 90; 90 | 442.157 | Pocza, J.; Naray-Szabo, S. Die Struktur des Silberchlorats Ag Cl O3 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1942, 104, 28-38 |
| 8103502 | CIF | C13.16 Al6.5728 Mg0.9392 O32.168 P7.504 | I 4/m | 13.2088; 13.2088; 5.2771 90; 90; 90 | 920.708 | Baur, W.H.; Bieniok, A.; Joswig, W.; Kassner, D.; Finger, G.; Kornatowski, J. The crystal structure of the microporous solid MAPO-39 (ATN) refined from single crystal diffraction data Zeitschrift fuer Kristallographie (149,1979-), 1999, 214, 154-159 |
| 8104111 | CIF | Sb1.07 Te6 Tl8.93 | I 4/m | 8.828; 8.828; 13.001 90; 90; 90 | 1013.22 | Doert, T.; Boettcher, P. Crystal structure of antimony nonathallium hexatelluride, SbTl9Te6 Zeitschrift fuer Kristallographie (149,1979-), 1994, 209, 96-96 |
| 8104117 | CIF | As4 Ta5 | I 4/m | 9.7975; 9.7975; 3.4296 90; 90; 90 | 329.211 | Dronskowski, R.; Simon, A.; Plambeck-Fischer, P. Verfeinerung der Kristallstrukturen von Ta5As4 und monoklinem Nb4.7Te4 Zeitschrift fuer Kristallographie (149,1979-), 1992, 198, 101-110 |
| 9000110 | CIF | Na4 O22 Si8 Ti2 | I 4/m | 10.7269; 10.7269; 7.9476 90; 90; 90 | 914.502 | Peacor, D. R.; Buerger, M. J. The determination and refinement of the structure of narsarsukite, Na2TiOSi4O10 American Mineralogist, 1962, 47, 539-556 |
| 9000130 | CIF | Al3.68 Ca0.76 Cl0.95 K0.08 Na3.16 O24 Si8.4 | I 4/m | 12.06; 12.06; 7.572 90; 90; 90 | 1101.3 | Papike, J. J.; Zoltai, T. The crystal structure of a marialite scapolite American Mineralogist, 1965, 50, 641-655 |
| 9000144 | CIF | C0.83 Al5.32 Ca2.68 Cl0.02 K0.44 Mg0.12 Na0.76 O27.09 S0.15 Si6.68 | I 4/m | 12.169; 12.169; 7.569 90; 90; 90 | 1120.85 | Papike, J. J.; Stephenson, N. C. The crystal structure of mizzonite, a calcium- and carbonate-rich scapolite American Mineralogist, 1966, 51, 1014-1027 |
| 9000764 | CIF | C2 H6 Ca O6.375 | I 4/m | 12.371; 12.371; 7.357 90; 90; 90 | 1125.93 | Tazzoli, V.; Domeneghetti, M. C. The crystal structures of whewellite and weddellite: re-examination and comparison American Mineralogist, 1980, 65, 327-334 |
| 9001378 | CIF | C4 Cl Cu4 O28 Pb4 Si4 | I 4/m | 14.234; 14.234; 6.103 90; 90; 90 | 1236.51 | Grice, J. D.; Nickel, E. H.; Gault, R. A. Ashburtonite, a new bicarbonate-silicate mineral from Ashburton Downs, Western Australia: Description and structure determination American Mineralogist, 1991, 76, 1701-1707 |
| 9001521 | CIF | Al K O8 Si3 | I 4/m | 9.315; 9.315; 2.723 90; 90; 90 | 236.273 | Zhang, J.; Ko, J.; Hazen, R. M.; Prewitt, C. T. High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 0.00 GPa American Mineralogist, 1993, 78, 493-499 |
| 9001522 | CIF | Al K O8 Si3 | I 4/m | 9.285; 9.285; 2.717 90; 90; 90 | 234.236 | Zhang, J.; Ko, J.; Hazen, R. M.; Prewitt, C. T. High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 1.64 GPa American Mineralogist, 1993, 78, 493-499 |
| 9001523 | CIF | Al K O8 Si3 | I 4/m | 9.261; 9.261; 2.712 90; 90; 90 | 232.598 | Zhang, J.; Ko, J.; Hazen, R. M.; Prewitt, C. T. High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 2.95 GPa American Mineralogist, 1993, 78, 493-499 |
| 9001524 | CIF | Al K O8 Si3 | I 4/m | 9.247; 9.247; 2.71 90; 90; 90 | 231.724 | Zhang, J.; Ko, J.; Hazen, R. M.; Prewitt, C. T. High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 3.60 GPa American Mineralogist, 1993, 78, 493-499 |
| 9001525 | CIF | Al K O8 Si3 | I 4/m | 9.237; 9.237; 2.706 90; 90; 90 | 230.882 | Zhang, J.; Ko, J.; Hazen, R. M.; Prewitt, C. T. High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 4.47 GPa American Mineralogist, 1993, 78, 493-499 |
| 9004136 | CIF | C0.68 Al3.28 Ca2.92 Cl0.03 Na0.92 O26.24 S0.29 Si2.36 | I 4/m | 12.158; 12.158; 7.573 90; 90; 90 | 1119.42 | Peterson, R. C.; Donnay, G.; Le Page, Y. Sulfate disorder in scapolite The Canadian Mineralogist, 1979, 17, 53-61 |
| 9004437 | CIF | Al3 Cl0.98 Na4 O24 Si9 | I 4/m | 12.0396; 12.0396; 7.5427 90; 90; 90 | 1093.33 | Sokolova, E. V.; Kabalov, Y. K.; Sherriff, B. L.; Teertstra, D. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C. Marialite: Rietveld structure-refinement and Si MAS and Al satellite transition NMR spectroscopy Sample: syn-mar The Canadian Mineralogist, 1996, 34, 1039-1050 |
| 9004438 | CIF | Al3.12 Ca0.2 Cl K0.28 Na3.52 O24 Si8.88 | I 4/m | 12.047; 12.047; 7.5602 90; 90; 90 | 1097.21 | Sokolova, E. V.; Kabalov, Y. K.; Sherriff, B. L.; Teertstra, D. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C. Marialite: Rietveld structure-refinement and Si MAS and Al satellite transition NMR spectroscopy Sample: PAM-1 The Canadian Mineralogist, 1996, 34, 1039-1050 |
| 9004439 | CIF | Al3.24 Ca0.28 Cl0.95 H0.05 K0.28 Na3.44 O24.05 Si8.76 | I 4/m | 12.0489; 12.0489; 7.5665 90; 90; 90 | 1098.47 | Sokolova, E. V.; Kabalov, Y. K.; Sherriff, B. L.; Teertstra, D. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C. Marialite: Rietveld structure-refinement and Si MAS and Al satellite transition NMR spectroscopy Sample: PAM-2 The Canadian Mineralogist, 1996, 34, 1039-1050 |
| 9004440 | CIF | Al3.24 Ca0.28 Cl0.96 H0.04 K0.16 Na3.52 O24.04 Si8.76 | I 4/m | 12.0546; 12.0546; 7.5684 90; 90; 90 | 1099.79 | Sokolova, E. V.; Kabalov, Y. K.; Sherriff, B. L.; Teertstra, D. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C. Marialite: Rietveld structure-refinement and Si MAS and Al satellite transition NMR spectroscopy Sample: PAM-3 The Canadian Mineralogist, 1996, 34, 1039-1050 |
| 9004464 | CIF | Ba0.561 O8 Ti4 | I 4/m | 10.15; 10.15; 2.952 90; 90; 90 | 304.122 | Foley, J. A.; Hughes, J. M.; Drexler, J. W. Redledgeite, Bax([Cr,Fe,V]2xTi8-2x)O16, the I4/m structure and elucidation of the sequence of tunnel Ba cations The Canadian Mineralogist, 1997, 35, 1531-1534 |
| 9004497 | CIF | Al3.68 Ca0.84 Cl0.84 K0.04 Na3.12 O24.24 S0.03 Si8.32 | I 4/m | 12.0415; 12.0415; 7.5809 90; 90; 90 | 1099.21 | Sherriff, B. L.; Sokolova, E. V.; Kabalov, Y. K.; Teertstra, D. K.; Kunath-Fandrei G; Goetz, S.; Jager, C. Intermediate scapolite: 29Si MAS and 26Al SATRAS NMR spectroscopy and Rietveld structure-refinement Sample: PAM-4 The Canadian Mineralogist, 1998, 36, 1267-1283 |
| 9004555 | CIF | Ba0.86 Ce0.02 Fe0.52 K0.01 La0.02 Na0.09 O8 Ti3.44 | I 4/m | 10.219; 10.219; 2.963 90; 90; 90 | 309.42 | Mitchell, R. H.; Yakovenchuk, V. N.; Chakhmouradian, A. R.; Burns, P. C.; Pakhomovsky, Y. A. Henrymeyerite, a new hollandite-type Ba-Fe titanate from the Kovdor Complex, Russia The Canadian Mineralogist, 2000, 38, 617-626 |
| 9004602 | CIF | C0.44 Al4.88 Ca2.68 Cl0.07 F0.03 K0.2 Na1.12 O25.32 Si7.12 | I 4/m | 12.1476; 12.1476; 7.5636 90; 90; 90 | 1116.12 | Sherriff, B. L.; Sokolova, E. V.; Kabalov, Y. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C.; Schneider, J. Meionite: Rietveld structure-refinement, Si MAS and Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series Note: sample BOLT The Canadian Mineralogist, 2000, 38, 1201-1213 |
| 9004603 | CIF | C0.32 Al5.2 Ca3.12 Cl0.01 K0.04 Na0.76 O25.28 S0.16 Si6.8 | I 4/m | 12.1637; 12.1637; 7.5739 90; 90; 90 | 1120.6 | Sherriff, B. L.; Sokolova, E. V.; Kabalov, Y. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C.; Schneider, J. Meionite: Rietveld structure-refinement, Si MAS and Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series Note: sample SL-1 The Canadian Mineralogist, 2000, 38, 1201-1213 |
| 9004604 | CIF | C0.44 Al5.88 Ca3.84 Cl0.01 K0.04 Na0.12 O25.4 S0.02 Si6.12 | I 4/m | 12.1969; 12.1969; 7.5763 90; 90; 90 | 1127.08 | Sherriff, B. L.; Sokolova, E. V.; Kabalov, Y. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C.; Schneider, J. Meionite: Rietveld structure-refinement, Si MAS and Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series Note: sample MONT The Canadian Mineralogist, 2000, 38, 1201-1213 |
| 9004605 | CIF | C0.13 Al1.5 Ca0.96 O6.39 Si1.5 | I 4/m | 12.2119; 12.2119; 7.5811 90; 90; 90 | 1130.57 | Sherriff, B. L.; Sokolova, E. V.; Kabalov, Y. K.; Jenkins, D. M.; Kunath-Fandrei G; Goetz, S.; Jager, C.; Schneider, J. Meionite: Rietveld structure-refinement, Si MAS and Al SATRAS NMR spectroscopy, and comments on the marialite-meionite series Sample: S.MEI, Synthetic The Canadian Mineralogist, 2000, 38, 1201-1213 |
| 9005639 | CIF | F K2 O10 Sc Si4 | I 4/m | 11.207; 11.207; 8.166 90; 90; 90 | 1025.62 | Kolitsch, U.; Tillmanns, E. The structural relation between the new synthetic silicate K2ScFSi4O10 and narsarsukite, Na2(Ti,Fe3+)(O,F)Si4O10 European Journal of Mineralogy, 2004, 16, 143-149 |
| 9007499 | CIF | Ba0.4 O8 Ti4 | I 4/m | 10.12; 10.12; 2.96 90; 90; 90 | 303.147 | Xiang, Shi-Bin; Fan, Hai-Fu; Wu, Xiao-Jing; Li, Fang-Hua; Pan, Q. Direct methods in superspace. II The first application to an unknown incommensurate modulated structure Note: this is the average structure, isomorphous with hollandite Note: y-coordinate of O2 altered from .248 to make regular TiO6 polyhedra Acta Crystallographica, Section A, 1990, 46, 929-934 |
| 9007646 | CIF | Ba0.1 Fe0.52 K0.66 Mg0.12 Na0.02 O8 Ti3.36 | I 4/m | 10.139; 10.139; 2.9664 90; 90; 90 | 304.944 | Post, J. E.; Von Dreele, R. B.; Buseck, P. R. Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: Anisotropic displacement factors from ICSD Acta Crystallographica, Section B, 1982, 38, 1056-1065 |
| 9009497 | CIF | Al Ca2 Cl F2 H8 O12 S2 | I 4/m | 6.87; 6.87; 13.342 90; 90; 90 | 629.701 | Starova, G. L.; Filatov, S. K.; Matusevich, G. L.; Fundamensky, V. S. The crystal structure of vlodavetsite, AlCa2(SO4)2F2Cl*4H2O Mineralogical Magazine, 1995, 59, 159-162 |
| 9009757 | CIF | Cu7 Se4 Tl | I 4/m | 10.45; 10.45; 3.9708 90; 90; 90 | 433.621 | Eriksson, L.; Werner, P. E.; Berger, R.; Meerschaut, A. Structure refinement of TlCu7Se4 from X-ray powder profile data Sample: GH Note: Cell parameters are an average of Table 1 values Journal of Solid State Chemistry, 1991, 90, 61-68 |
| 9009758 | CIF | Cu7 Se4 Tl | I 4/m | 10.45; 10.45; 3.9708 90; 90; 90 | 433.621 | Eriksson, L.; Werner, P. E.; Berger, R.; Meerschaut, A. Structure refinement of TlCu7Se4 from X-ray powder profile data Sample: STADI/P Note: Cell parameters are an average of Table 1 values Journal of Solid State Chemistry, 1991, 90, 61-68 |
| 9009759 | CIF | Cu6.52 Se4 Tl | I 4/m | 10.4445; 10.4445; 3.9378 90; 90; 90 | 429.565 | Eriksson, L.; Werner, P. E.; Berger, R.; Meerschaut, A. Structure refinement of TlCu7Se4 from X-ray powder profile data Sample: Single crystal Journal of Solid State Chemistry, 1991, 90, 61-68 |
| 9010507 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.16711; 12.16711; 7.575466 90; 90; 90 | 1121.46 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 25 C (HRPXRD) American Mineralogist, 2008, 93, 1470-1477 |
| 9010508 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.1667; 12.1667; 7.5758 90; 90; 90 | 1121.44 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 26 C American Mineralogist, 2008, 93, 1470-1477 |
| 9010509 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.1736; 12.1736; 7.5757 90; 90; 90 | 1122.69 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 101 American Mineralogist, 2008, 93, 1470-1477 |
| 9010510 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.1834; 12.1834; 7.5761 90; 90; 90 | 1124.56 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 196 American Mineralogist, 2008, 93, 1470-1477 |
| 9010511 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.195; 12.195; 7.5771 90; 90; 90 | 1126.85 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 296 American Mineralogist, 2008, 93, 1470-1477 |
| 9010512 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.2067; 12.2067; 7.578 90; 90; 90 | 1129.15 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 396 American Mineralogist, 2008, 93, 1470-1477 |
| 9010513 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.2192; 12.2192; 7.5792 90; 90; 90 | 1131.64 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 494 American Mineralogist, 2008, 93, 1470-1477 |
| 9010514 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.2322; 12.2322; 7.5806 90; 90; 90 | 1134.26 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 594 American Mineralogist, 2008, 93, 1470-1477 |
| 9010515 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.2475; 12.2475; 7.5823 90; 90; 90 | 1137.35 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 694 American Mineralogist, 2008, 93, 1470-1477 |
| 9010516 | CIF | C0.834 Al4.68 Ca3.176 Na0.824 O27.084 S0.146 Si7.32 | I 4/m | 12.2618; 12.2618; 7.5841 90; 90; 90 | 1140.28 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 793 American Mineralogist, 2008, 93, 1470-1477 |
| 9010517 | CIF | C0.834 Al4.08 Ca3.176 Na0.824 O27.084 S0.146 Si7.92 | I 4/m | 12.2778; 12.2778; 7.5861 90; 90; 90 | 1143.56 | Antao, S. M.; Hassan, I. Unusual Al-Si ordering in calcic scapolite, Me79.6, with increasing temperature T = 900 American Mineralogist, 2008, 93, 1470-1477 |
| 9011346 | CIF | C8 H24 Ca Cu O14 | I 4/m | 11.152; 11.152; 16.24 90; 90; 90 | 2019.72 | Klop, E. A.; Duisenberg, A. J. M.; Spek, A. L. Reinvestigation of the structure of calcium copper acetate hexahydrate, CaCu(C2H3O2)4*6H2O Acta Crystallographica, Section C, 1983, 39, 1342-1344 |
| 9011805 | CIF | C0.478 Al4.872 Ca2.452 Na1.548 O27.524 S0.522 Si7.128 | I 4/m | 12.16; 12.16; 7.56 90; 90; 90 | 1117.86 | Teertstra, D. K.; Schindler, M.; Sherriff, B. L.; Hawthorne, F. C. Silvialite, a new sulfate-dominant member of the scapolite group with an Al-Si composition near the I4/m-P42/n phase transition Mineralogical Magazine, 1999, 63, 321-329 |
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