Crystallography Open Database
Search results
Result: there are 13385 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching year of publication is 2004
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 9007276 | CIF | Al2 Ca H10 O15.02 Si4 | C 1 2/m 1 | 14.7514; 13.0827; 7.5648 90; 111.997; 90 | 1353.64 | Lee, Y.; Hriljac, J. A.; Vogt, T. Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = ambient Physics and Chemistry of Minerals, 2004, 31, 421-428 |
| 9007277 | CIF | Al4 Ca2 H22 O33 Si8 | C 1 2/m 1 | 14.8831; 13.182; 7.5387 90; 110.181; 90 | 1388.21 | Lee, Y.; Hriljac, J. A.; Vogt, T. Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 0.2 GPa Physics and Chemistry of Minerals, 2004, 31, 421-428 |
| 9007278 | CIF | Al4 Ca2 H22 O33 Si8 | C 1 2/m 1 | 14.8913; 13.1661; 7.5284 90; 110.008; 90 | 1386.94 | Lee, Y.; Hriljac, J. A.; Vogt, T. Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 0.3 GPa Physics and Chemistry of Minerals, 2004, 31, 421-428 |
| 9007279 | CIF | Al4 Ca2 H18 O33 Si8 | C 1 2/m 1 | 14.8795; 13.1442; 7.5078 90; 109.92; 90 | 1380.52 | Lee, Y.; Hriljac, J. A.; Vogt, T. Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 0.6 GPa Physics and Chemistry of Minerals, 2004, 31, 421-428 |
| 9007280 | CIF | Al4 Ca2 H18 O33 Si8 | C 1 2/m 1 | 14.8486; 13.1211; 7.4774 90; 110.001; 90 | 1368.96 | Lee, Y.; Hriljac, J. A.; Vogt, T. Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 1.1 GPa Physics and Chemistry of Minerals, 2004, 31, 421-428 |
| 9007281 | CIF | Al4 Ca2 H18 O33 Si8 | C 1 2/m 1 | 14.7934; 13.0979; 7.442 90; 110.166; 90 | 1353.58 | Lee, Y.; Hriljac, J. A.; Vogt, T. Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 1.7 GPa Physics and Chemistry of Minerals, 2004, 31, 421-428 |
| 9007282 | CIF | Al2 Ca H12 O16.5 Si4 | C 1 2/m 1 | 14.7204; 13.1084; 7.408 90; 110.512; 90 | 1338.82 | Lee, Y.; Hriljac, J. A.; Vogt, T. Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 2.4 GPa Physics and Chemistry of Minerals, 2004, 31, 421-428 |
| 9007283 | CIF | Fe Mn1.911 Na1.896 O12 P3 | C 1 2/c 1 | 12.048; 12.623; 6.511 90; 114.58; 90 | 900.474 | Hatert, F.; Long, G. J.; Hautot, D.; Fransolet, A.-M.; Delwiche, J.; Hubin-Franskin M J; Grandjean, F. A structural, magnetic, and Mossbauer spectral study of several Na-Mn-Fe-bearing alluaudites Sample: #1, synthetic Physics and Chemistry of Minerals, 2004, 31, 487-506 |
| 9007284 | CIF | Fe2.919 H6 O14.905 S2 | R -3 m :H | 7.3559; 7.3559; 17.0186 90; 90; 120 | 797.491 | Majzlan J; Stevens R; Boerio-Goates J; Woodfield B F; Navrotsky A; Burns P C; Crawford M K; Amos T G Thermodynamic properties, low-temperature heat-capacity anomalies, and single-crystal X-ray refinement of hydronium jarosite, (H3O)Fe3(SO4)2(OH)6 Note: Single-crystal X-ray diffraction refinement Physics and Chemistry of Minerals, 2004, 31, 518-531 |
| 9007285 | CIF | Fe3 H9 O15 S2 | R -3 m :H | 7.3499; 7.3499; 17.0104 90; 90; 120 | 795.807 | Majzlan J; Stevens R; Boerio-Goates J; Woodfield B F; Navrotsky A; Burns P C; Crawford M K; Amos T G Thermodynamic properties, low-temperature heat-capacity anomalies, and single-crystal X-ray refinement of hydronium jarosite, (H3O)Fe3(SO4)2(OH)6 Note: Rietveld refinement of synchrotron X-ray diffraction pattern Physics and Chemistry of Minerals, 2004, 31, 518-531 |
| 9007286 | CIF | C Ca O3 | R -3 c :H | 5.0492; 5.0492; 17.343 90; 90; 120 | 382.913 | Prencipe, M.; Pascale, F.; Zicovich-Wilson C M; Saunders, V. R.; Orlando, R.; Dovesi, R. The vibrational spectrum of calcite (CaCO3): an ab initio quantum-mechanical calculation Note: Theoretically derived structure Physics and Chemistry of Minerals, 2004, 31, 559-564 |
| 9007287 | CIF | Ca D5 O6 P | I 1 a 1 | 5.79903; 15.1254; 6.18398 90; 116.429; 90 | 485.724 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 4.2 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007288 | CIF | Ca D5 O6 P | I 1 a 1 | 5.799; 15.1255; 6.1839 90; 116.428; 90 | 485.722 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 10 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007289 | CIF | Ca D5 O6 P | I 1 a 1 | 5.7991; 15.1251; 6.184 90; 116.429; 90 | 485.722 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Note: Obvious typo in the x-coordinate of D2 corrected Sample: T = 20 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007290 | CIF | Ca D5 O6 P | I 1 a 1 | 5.799; 15.1255; 6.1839 90; 116.427; 90 | 485.727 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 30 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007291 | CIF | Ca D5 O6 P | I 1 a 1 | 5.7991; 15.1253; 6.1842 90; 116.428; 90 | 485.748 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 40 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007292 | CIF | Ca D5 O6 P | I 1 a 1 | 5.7992; 15.1256; 6.1844 90; 116.426; 90 | 485.79 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 50 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007293 | CIF | Ca D5 O6 P | I 1 a 1 | 5.7994; 15.125; 6.185 90; 116.426; 90 | 485.835 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 60 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007294 | CIF | Ca D5 O6 P | I 1 a 1 | 5.7997; 15.1257; 6.1857 90; 116.425; 90 | 485.942 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 70 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007295 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8; 15.1256; 6.1866 90; 116.422; 90 | 486.047 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 80 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007296 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8003; 15.1259; 6.1873 90; 116.422; 90 | 486.137 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 90 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007297 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8007; 15.1267; 6.1887 90; 116.419; 90 | 486.318 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 100 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007298 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8016; 15.1284; 6.1916 90; 116.418; 90 | 486.681 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 125 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007299 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8026; 15.1314; 6.1956 90; 116.416; 90 | 487.184 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 150 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007300 | CIF | Ca D5 O6 P | I 1 a 1 | 5.804; 15.1361; 6.2006 90; 116.414; 90 | 487.855 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 175 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007301 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8053; 15.142; 6.206 90; 116.413; 90 | 488.584 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 200 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007302 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8062; 15.1482; 6.2118 90; 116.41; 90 | 489.329 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 225 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007303 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8077; 15.1563; 6.2186 90; 116.408; 90 | 490.262 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 250 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007304 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8091; 15.1656; 6.2259 90; 116.407; 90 | 491.261 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 275 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007305 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8105; 15.1758; 6.2337 90; 116.405; 90 | 492.335 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 300 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007306 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8119; 15.1867; 6.2416 90; 116.405; 90 | 493.432 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 325 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007307 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8132; 15.1973; 6.2497 90; 116.406; 90 | 494.523 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 350 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007308 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8145; 15.2086; 6.258 90; 116.408; 90 | 495.65 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 375 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007309 | CIF | Ca D5 O6 P | I 1 a 1 | 5.8151; 15.2179; 6.2664 90; 116.413; 90 | 496.649 | Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 400 K Physics and Chemistry of Minerals, 2004, 31, 606-624 |
| 9007310 | CIF | Cr2 Mg O4 | F d -3 m :2 | 8.3329; 8.3329; 8.3329 90; 90; 90 | 578.613 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: MgCr5 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007311 | CIF | Cr2 Mg O4 | F d -3 m :2 | 8.3328; 8.3328; 8.3328 90; 90; 90 | 578.593 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: MgCr9A Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007312 | CIF | Cr1.992 Fe0.024 Mg0.984 O4 | F d -3 m :2 | 8.334; 8.334; 8.334 90; 90; 90 | 578.843 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-20 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007313 | CIF | Cr1.996 Fe0.072 Mg0.932 O4 | F d -3 m :2 | 8.3352; 8.3352; 8.3352 90; 90; 90 | 579.093 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-10 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007314 | CIF | Cr2 Fe0.13 Mg0.87 O4 | F d -3 m :2 | 8.3379; 8.3379; 8.3379 90; 90; 90 | 579.656 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-10B Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007315 | CIF | Cr2 Fe0.2 Mg0.8 O4 | F d -3 m :2 | 8.3415; 8.3415; 8.3415 90; 90; 90 | 580.407 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-30 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007316 | CIF | Cr2 Fe0.32 Mg0.68 O4 | F d -3 m :2 | 8.3462; 8.3462; 8.3462 90; 90; 90 | 581.388 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-50 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007317 | CIF | Cr2 Fe0.33 Mg0.67 O4 | F d -3 m :2 | 8.349; 8.349; 8.349 90; 90; 90 | 581.974 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-40 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007318 | CIF | Cr2 Fe0.37 Mg0.63 O4 | F d -3 m :2 | 8.3465; 8.3465; 8.3465 90; 90; 90 | 581.451 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-20B Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007319 | CIF | Cr2 Fe0.6 Mg0.4 O4 | F d -3 m :2 | 8.3577; 8.3577; 8.3577 90; 90; 90 | 583.795 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-45 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007320 | CIF | Cr2 Fe0.65 Mg0.35 O4 | F d -3 m :2 | 8.362; 8.362; 8.362 90; 90; 90 | 584.696 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-60 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007321 | CIF | Cr2 Fe0.67 Mg0.33 O4 | F d -3 m :2 | 8.3613; 8.3613; 8.3613 90; 90; 90 | 584.55 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-55 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007322 | CIF | Cr2 Fe0.76 Mg0.24 O4 | F d -3 m :2 | 8.3672; 8.3672; 8.3672 90; 90; 90 | 585.788 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-70 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007323 | CIF | Cr2 Fe0.87 Mg0.13 O4 | F d -3 m :2 | 8.371; 8.371; 8.371 90; 90; 90 | 586.586 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-80 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007324 | CIF | Cr2 Fe0.91 Mg0.09 O4 | F d -3 m :2 | 8.3739; 8.3739; 8.3739 90; 90; 90 | 587.196 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-90 Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007325 | CIF | Cr2 Fe O4 | F d -3 m :2 | 8.3765; 8.3765; 8.3765 90; 90; 90 | 587.743 | Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U. Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2- Physics and Chemistry of Minerals, 2004, 31, 633-642 |
| 9007326 | CIF | Al D4 N O8 Si3 | C 1 2/m 1 | 8.79182; 13.11084; 7.20473 90; 116.097; 90 | 745.809 | Mookherjee, M.; Redfern, S. A. T.; Swainson, I.; Harlov, D. E. Low-temperature behaviour of ammonium ion in buddingtonite [N(D/H)4AlSi3O8] from neutron powder diffraction Sample: T = 11 K Physics and Chemistry of Minerals, 2004, 31, 643-649 |
| 9007327 | CIF | Al D4 N O8 Si3 | C 1 2/m 1 | 8.81611; 13.09609; 7.20155 90; 116.121; 90 | 746.546 | Mookherjee, M.; Redfern, S. A. T.; Swainson, I.; Harlov, D. E. Low-temperature behaviour of ammonium ion in buddingtonite [N(D/H)4AlSi3O8] from neutron powder diffraction Sample: T = 210 K Physics and Chemistry of Minerals, 2004, 31, 643-649 |
| 9007328 | CIF | Al D4 N O8 Si3 | C 1 2/m 1 | 8.83157; 13.08541; 7.20024 90; 116.147; 90 | 746.943 | Mookherjee, M.; Redfern, S. A. T.; Swainson, I.; Harlov, D. E. Low-temperature behaviour of ammonium ion in buddingtonite [N(D/H)4AlSi3O8] from neutron powder diffraction Sample: T = 280 K Physics and Chemistry of Minerals, 2004, 31, 643-649 |
| 9007959 | CIF | Na3 O S3 V | C m c 21 | 9.6673; 11.9122; 5.8846 90; 90; 90 | 677.664 | Huang, F. Q.; Ibers, J. A. Na3VOS3 Acta Crystallographica, Section E, 2004, 60, i6-i7 |
| 9007960 | CIF | Rb2 S4 W | P n m a | 9.6254; 7.0218; 12.3761 90; 90; 90 | 836.471 | Yao, J.; Ibers, J. A. Dirubidium tetrathiotungstate, Rb2[WS4] Acta Crystallographica, Section E, 2004, 60, i10-i11 |
| 9007962 | CIF | Ca K O9 P3 | P -6 c 2 | 6.809; 6.809; 10.376 90; 90; 120 | 416.608 | Sandstrom, M.; Bostrom, D. Calcium potassium cyclo-triphosphate Acta Crystallographica, Section E, 2004, 60, i15-i17 |
| 9007965 | CIF | Cs La O12 P4 | P 1 21 1 | 7.218; 9.254; 8.864 90; 99.377; 90 | 584.163 | Sun, T.; Shen, G.; Wang, X.; Wang, R.; Wei, J.; Shen, D. CsLa(PO3)4 Acta Crystallographica, Section E, 2004, 60, i28-i30 |
| 9007966 | CIF | Cl2 Cu H16 O16 | P 1 21/c 1 | 6.2908; 12.4043; 9.2181 90; 106.146; 90 | 690.943 | Li, X. H.; Xia, F. Y.; Xiao, H. P.; Hu, M. L. Hexaaquacopper(II) diperchlorate dihydrate Acta Crystallographica, Section E, 2004, 60, i31-i32 |
| 9007972 | CIF | Br Eu I | P n m a | 8.3723; 4.7404; 9.799 90; 90; 90 | 388.903 | Liao, W.; Liu, X.; Dronskowski, R. Europium(II) bromide iodide Acta Crystallographica, Section E, 2004, 60, i69-i71 |
| 9007976 | CIF | Cr H28 N O20 S2 | P a -3 | 12.2491; 12.2491; 12.2491 90; 90; 90 | 1837.86 | Rempfer, N.; Lerner, H. W.; Bolte, M. The ammonium chromium(III) alum NH4Cr(SO4)2*12H2O Acta Crystallographica, Section E, 2004, 60, i80-i81 |
| 9007978 | CIF | Li O12 P4 Yb | C 1 2/c 1 | 16.194; 7.024; 9.498 90; 125.91; 90 | 875.031 | Zarkouna, E. B.; Driss, A. LiYb(PO3)4 Acta Crystallographica, Section E, 2004, 60, i102-i104 |
| 9008440 | CIF | Al Li O6 Si2 | C 1 2/c 1 | 9.474; 8.39; 5.219 90; 110.07; 90 | 389.65 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiAl Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008441 | CIF | Ga Li O6 Si2 | C 1 2/c 1 | 9.593; 8.584; 5.284 90; 110.22; 90 | 408.303 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiGa Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008442 | CIF | Cr Li O6 Si2 | C 1 2/c 1 | 9.57; 8.582; 5.268 90; 110.18; 90 | 406.1 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiCr Sample: T = 335 K Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008443 | CIF | Li O6 Si2 V | C 1 2/c 1 | 9.657; 8.623; 5.287 90; 110.15; 90 | 413.314 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiV Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008444 | CIF | Fe Li O6 Si2 | C 1 2/c 1 | 9.664; 8.66; 5.293 90; 110.19; 90 | 415.753 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiFe Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008445 | CIF | Fe0.873 Li O6 Sc0.127 Si2 | C 1 2/c 1 | 9.678; 8.697; 5.3 90; 110.15; 90 | 418.795 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: ScFe90 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008446 | CIF | Fe0.826 Li O6 Sc0.177 Si2 | C 1 2/c 1 | 9.686; 8.718; 5.308 90; 110.2; 90 | 420.652 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: ScFe75 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008447 | CIF | Fe0.739 Li O6 Sc0.261 Si2 | C 1 2/c 1 | 9.704; 8.737; 5.312 90; 110.2; 90 | 422.671 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: ScFe70 Note: y(O3) changed to match reported bond lengths Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008448 | CIF | Fe0.573 Li O6 Sc0.426 Si2 | C 1 2/c 1 | 9.723; 8.795; 5.322 90; 110.25; 90 | 426.975 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: ScFe50 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008449 | CIF | Fe0.385 Li O6 Sc0.614 Si2 | C 1 2/c 1 | 9.747; 8.846; 5.335 90; 110.28; 90 | 431.479 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: ScFe40 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008450 | CIF | Fe0.087 Li O6 Sc0.913 Si2 | C 1 2/c 1 | 9.794; 8.917; 5.351 90; 110.36; 90 | 438.124 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: ScFe25 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008451 | CIF | Li O6 Sc Si2 | C 1 2/c 1 | 9.805; 8.949; 5.358 90; 110.39; 90 | 440.68 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: ScPx Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008452 | CIF | Li O6 Sc Si2 | C 1 2/c 1 | 9.805; 8.949; 5.358 90; 110.39; 90 | 440.68 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiSc2 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008453 | CIF | In0.203 Li O6 Sc0.787 Si2 | C 1 2/c 1 | 9.801; 8.965; 5.361 90; 110.38; 90 | 441.563 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiIn25 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008454 | CIF | In0.289 Li O6 Sc0.71 Si2 | C 1 2/c 1 | 9.801; 8.985; 5.366 90; 110.38; 90 | 442.961 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiIn50 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008455 | CIF | In0.553 Li O6 Sc0.447 Si2 | C 1 2/c 1 | 9.802; 9.005; 5.37 90; 110.41; 90 | 444.237 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiIn65 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008456 | CIF | In0.815 Li O6 Sc0.185 Si2 | C 1 2/c 1 | 9.806; 9.035; 5.377 90; 110.46; 90 | 446.335 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiIn90 Note: y(Si) changed to match reported bond lengths Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9008457 | CIF | In Li O6 Si2 | C 1 2/c 1 | 9.807; 9.055; 5.383 90; 110.49; 90 | 447.78 | Redhammer, G. J.; Roth, G. Structural variation and crystal chemistry of LiMe3+Si2O6 clinopyroxenes Me3+ = Al, Ga, Cr, V, Fe, Sc, and In Sample: LiIn100 Zeitschrift fur Kristallographie, 2004, 219, 278-294 |
| 9009217 | CIF | Mg O3 Si | C m c m | 2.456; 8.042; 6.093 90; 90; 90 | 120.344 | Murakami, M.; Hirose, K.; Kawamura, K.; Sata, N.; Ohishi, Y. Post-perovskite phase transition in MgSiO3 Sample: P = 121 GPa, T = 300 K Note: CaIrO3-type structure from ab initio calculations using observed cell parameters Science, 2004, 304, 855-858 |
| 9009429 | CIF | Ba Be2 O7 Si2 | P m n 21 | 11.65; 4.922; 4.674 90; 90; 90 | 268.013 | Krivovichev, S. V.; Yakovenchuk, V. N.; Armbruster, T.; Mikhailova, Y.; Pakhomovsky, Y. A. Clinobarylite, BaBe2Si2O7: Structure refinement, and revision of symmetry and physical properties Locality: Khibina alkaline massif, Kola Peninsula, Russia Neues Jahrbuch fur Mineralogie, Monatshefte, 2004, 2004, 373-384 |
| 9009747 | CIF | O3 Sb2 | F d -3 m :2 | 11.116; 11.116; 11.116 90; 90; 90 | 1373.55 | Whitten, A. E.; Dittrich, B.; Spackman, M. A.; Turner, P.; Brown, T. C. Charge density analysis of two polymorphs of antimony(III) oxide Dalton Transactions, 2004, 2004, 23-29 |
| 9009748 | CIF | O3 Sb2 | P c c n | 4.8996; 12.449; 5.4103 90; 90; 90 | 330.002 | Whitten, A. E.; Dittrich, B.; Spackman, M. A.; Turner, P.; Brown, T. C. Charge density analysis of two polymorphs of antimony(III) oxide Dalton Transactions, 2004, 2004, 23-29 |
| 9009816 | CIF | Br Hg3 I Te2 | C 1 2 1 | 18.376; 9.587; 10.575 90; 90.12; 90 | 1863 | Minets, Y. V.; Voroshilov, Y. V.; Pan'ko, V. V. The structures of mercury chalcogenhalogenides Hg3X2Hal2 Journal of Alloys and Compounds, 2004, 367, 109-114 |
| 9009817 | CIF | Br3 Hg6 I S4 | P 4 21 2 | 13.32; 13.32; 4.465 90; 90; 90 | 792.191 | Minets, Y. V.; Voroshilov, Y. V.; Pan'ko, V. V. The structures of mercury chalcogenhalogenides Hg3X2Hal2 Note: synthetic, superstructure Journal of Alloys and Compounds, 2004, 367, 109-114 |
| 9010007 | CIF | Fe H4 O6 P | P b c a | 8.722; 9.878; 10.1187 90; 90; 90 | 871.786 | Taxer, K.; Bartl, H. On the dimorphy between the variscite and clinovariscite group: refined finestructural relationship of strengite and clinostrengite, Fe(PO4)*2H2O Note: x(O3) corrected to match reported bond lengths Crystal Research and Technology, 2004, 39, 1080-1088 |
| 9010008 | CIF | Fe H4 O6 P | P 1 21/n 1 | 5.335; 9.808; 8.72 90; 90.54; 90 | 456.26 | Taxer, K.; Bartl, H. On the dimorphy between the variscite and clinovariscite group: refined finestructural relationship of strengite and clinostrengite, Fe(PO4)*2H2O Crystal Research and Technology, 2004, 39, 1080-1088 |
| 9010569 | CIF | Ce0.45 F0.88 La0.46 Nd0.07 O1.12 Pr0.02 | F m -3 m | 5.6282; 5.6282; 5.6282 90; 90; 90 | 178.282 | Holtstam, D.; Grins, J.; Nysten, P. Haleniusite-(La) from the Bastnas deposit, Vastmanland, Sweden: A new REE oxyfluoride mineral species The Canadian Mineralogist, 2004, 42, 1097-1103 |
| 9011079 | CIF | Cl K O4 | P n m a | 8.7684; 5.6237; 7.2039 90; 90; 90 | 355.23 | Marabello, D.; Bianchi, R.; Gervasio, G.; Cargnoni, F. An experimental (120K) and theoretical electron-density study of KMnO4 and KClO4 Locality: synthetic Note: potassium perchlorate T = 120 K Acta Crystallographica, Section A, 2004, 60, 494-501 |
| 9011389 | CIF | H40 Mg2 Na2 O48 V10 | C 1 2/c 1 | 23.8384; 11.0248; 16.9332 90; 118.005; 90 | 3929.18 | Iida, A.; Ozeki, T. Mg2Na2V10O28*20H2O and Mg3V10O28*28H2O Acta Crystallographica, Section C, 2004, 60, i43-i46 |
| 9011390 | CIF | H54.684 Mg3 O56 V10 | P -1 | 10.4834; 10.7309; 21.2293 90.751; 97.866; 103.663 | 2296.24 | Iida, A.; Ozeki, T. Mg2Na2V10O28*20H2O and Mg3V10O28*28H2O Acta Crystallographica, Section C, 2004, 60, i43-i46 |
| 9011732 | CIF | Al0.06 Ca8 Cl1.858 Fe0.028 Mg0.912 O16.142 Si4 | F d -3 :2 | 15.085; 15.085; 15.085 90; 90; 90 | 3432.7 | Mihajlovic, T.; Lengauer, C. L.; Ntaflos, T.; Lolitsch, U.; Tillmanns, E. Two new minerals, rondorfite, Ca8Mg[SiO4]4Cl2, and almarudite, K(box,Na)2(Mn,Fe,Mg)2(Be,Al)3[Si12O30], and a study of iron-rich wadalite, Ca12[(Al8Si4Fe2)O32]C16, from the Bellerberg (Bellberg) volcano, Eifel, Germany Locality: Bellerberg volcano lava field, 2 km N of Mayen, Eastern Eifel volcanic area, Eifel, Germany Neues Jahrbuch fur Mineralogie, Abhandlungen, 2004, 179, 265-294 |
| 9011733 | CIF | Al0.786 Be2.214 Fe0.62 K0.928 Mg0.322 Mn1.058 Na0.2 O30 Si12 | P 6/m c c | 9.997; 9.997; 14.09 90; 90; 120 | 1219.5 | Mihajlovic, T.; Lengauer, C. L.; Ntaflos, T.; Lolitsch, U.; Tillmanns, E. Two new minerals, rondorfite, Ca8Mg[SiO4]4Cl2, and almarudite, K(box,Na)2(Mn,Fe,Mg)2(Be,Al)3[Si12O30], and a study of iron-rich wadalite, Ca12[(Al8Si4Fe2)O32]C16, from the Bellerberg (Bellberg) volcano, Eifel, Germany Locality: Bellerberg volcano lava field, 2 km N of Mayen, Eastern Eifel volcanic area, Eifel, Germany Neues Jahrbuch fur Mineralogie, Abhandlungen, 2004, 179, 265-294 |
| 9011734 | CIF | Al3.688 Ca6 Cl2.847 Fe0.807 Mg0.339 O16 Si2.09 Ti0.076 | I -4 3 d | 12.0343; 12.0343; 12.0343 90; 90; 90 | 1742.86 | Mihajlovic, T.; Lengauer, C. L.; Ntaflos, T.; Lolitsch, U.; Tillmanns, E. Two new minerals, rondorfite, Ca8Mg[SiO4]4Cl2, and almarudite, K(box,Na)2(Mn,Fe,Mg)2(Be,Al)3[Si12O30], and a study of iron-rich wadalite, Ca12[(Al8Si4Fe2)O32]C16, from the Bellerberg (Bellberg) volcano, Eifel, Germany Locality: Bellerberg volcano lava field, 2 km N of Mayen, Eastern Eifel volcanic area, Eifel, Germany Neues Jahrbuch fur Mineralogie, Abhandlungen, 2004, 179, 265-294 |
| 9011770 | CIF | Ca5.151 Cl1.74 Fe1.932 Hf0.051 K0.171 Mn1.503 Na10.65 Nb1.27 O76.401 Si24.45 Sn0.03 Sr3.87 Y0.138 Zr2.88 | R 3 m :H | 14.2828; 14.2828; 30.0222 90; 90; 120 | 5303.96 | Petersen, O. V.; Johnsen, O.; Gault, R. A.; Niedermayr, G.; Grice, J. D. Taseqite, a new member of the eudialyte group from the Ilimaussaq alkaline complex, South Greenland Locality: Ilimaussaq alkaline complex, South Greenland Note: water and OHs located at O20 and O21 Neues Jahrbuch fur Mineralogie, Monatshefte, 2004, 2004, 83-96 |
| 9011771 | CIF | F0.4 Fe4.46 H1.6 K0.684 Li0.28 Mn0.2 Na2.216 O23.6 Si8 Ti0.06 | C 1 2/m 1 | 10.002; 18.054; 5.319 90; 103.9; 90 | 932.358 | Pekov, I. V.; Chukanov, N. V.; Lebedeva, Y. S.; Pushcharovsky, D. Y.; Ferraris, G.; Gula, A.; Zadov, A. E.; Novakova, A. A.; Petersen, O. V. Potassicarfvedsonite, KNa2Fe2+4Fe3+Si8O22(OH)2,a K-dominant amphibole of the arfvedsonite series from agpaitic pegmatites - Mineral data, structure refinement and disorder in the A site Neues Jahrbuch fur Mineralogie, Monatshefte, 2004, 2004, 555-574 |
| 9011825 | CIF | As0.476 Cu0.356 Fe9 H19 Na O38 P5.524 | P 1 2/c 1 | 20.117; 5.185; 13.978 90; 107.07; 90 | 1393.77 | Kolitsch, U. The crystal structures of kidwellite and 'laubmannite', two complex fibrous iron phosphates Mineralogical Magazine, 2004, 68, 147-165 |
| 9011826 | CIF | As10 Co4.5 Cu0.8 Ni4.7 O35 | C 1 2 1 | 33.256; 8.482; 14.191 90; 104.145; 90 | 3881.59 | Roberts, A. C.; Burns, P. C.; Gault, R. A.; Criddle, A. J.; Feinglos, M. N. Petewilliamsite, (Ni,Co)30(As2O7)15, a new mineral from Johanngeorgenstadt, Saxony, Germany: description and crystal structure Mineralogical Magazine, 2004, 68, 231-240 |
| 9011827 | CIF | Cl O4 Pb3.5 Si0.5 | I 4/m m m | 3.8932; 3.8932; 22.803 90; 90; 90 | 345.625 | Welch, M. D. Pb-Si ordering in sheet-oxychloride minerals: the super-structure of asisite, nominally Pb7SiO8Cl2 Locality: Kombat mine, Namibia Mineralogical Magazine, 2004, 68, 247-254 |
| 9011942 | CIF | H3 Mn0.24 Na5.29 Nd0.1 O18 Si6 Ti0.05 Zr0.91 | C 1 2/m 1 | 10.69; 10.31; 7.407 90; 92.4; 90 | 815.638 | Yamnova, N. A.; Egorov-Tismenko Y K; Pekov, I. V.; Shchegol'kova, L. V. Crystal structure of kapustinite Na5.5Mn0.25Zr[Si6O16(OH)2] - a new mineral of the lovozerite group Doklady Akademii Nauk SSSR, 2004, 396, 680-685 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

