Crystallography Open Database
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COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
9016967 | CIF | Al2 Ca H9 O12.5 Si2 | P 1 21/c 1 | 10.0214; 10.5997; 9.8327 90; 92.363; 90 | 1043.58 | Wadoski-Romeijn E; Armbruster, T. Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure Note: T = 25 C, Phase A, Path 1 American Mineralogist, 2013, 98, 1988-1997 |
9016968 | CIF | Al2 Ca H6 O11 Si2 | P 21 21 21 | 13.6801; 10.467; 13.8667 90; 90; 90 | 1985.57 | Wadoski-Romeijn E; Armbruster, T. Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure Note: T = 75 C, Phase B, Path 1 American Mineralogist, 2013, 98, 1988-1997 |
9016969 | CIF | Al4 Ca1.941 H8 O20 Si4 | P 21 21 21 | 13.9014; 8.9469; 13.9697 90; 90; 90 | 1737.47 | Wadoski-Romeijn E; Armbruster, T. Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure Note: T = 150 C, Phase C, Path 1 American Mineralogist, 2013, 98, 1988-1997 |
9016970 | CIF | Al Ca0.44 H4.09 O6.045 Si | I 1 2/a 1 | 9.79; 10.437; 9.79 90; 90.97; 90 | 1000.18 | Wadoski-Romeijn E; Armbruster, T. Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure Note: T = 75 C, Path 2 American Mineralogist, 2013, 98, 1988-1997 |
9016971 | CIF | Al2 Ca0.946 H2 O9 Si2 | I 1 2/a 1 | 9.434; 9.044; 9.695 90; 89.04; 90 | 827.072 | Wadoski-Romeijn E; Armbruster, T. Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure Note: T = 225 C, Path 2 American Mineralogist, 2013, 98, 1988-1997 |
9016972 | CIF | Al Ca0.5 O4 Si | C -1 | 8.152; 12.917; 7.126 93.26; 116.37; 88.72 | 671.192 | Wadoski-Romeijn E; Armbruster, T. Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure Note: T = 350 C, Path 2, synthesised from gismondine American Mineralogist, 2013, 98, 1988-1997 |
9016973 | CIF | Al3.735 H31.134 K Mg0.222 Na2.484 O51.567 Si14.265 | P 63/m m c | 13.23574; 13.23574; 15.06516 90; 90; 120 | 2285.6 | Cametti, G.; Pacella, A.; Mura, F.; Rossi, M.; Ballirano, P. New morphological, chemical, and structural data of woolly erionite-Na from Durkee, Oregon, U.S.A. American Mineralogist, 2013, 98, 2155-2163 |
9016974 | CIF | C2 H4.27 Ca O6.135 | I 4/m | 12.3363; 12.3363; 7.3448 90; 90; 90 | 1117.76 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 1 American Mineralogist, 2014, 99, 2-7 |
9016975 | CIF | C2 H4.4 Ca O6.2 | I 4/m | 12.3543; 12.3543; 7.3547 90; 90; 90 | 1122.54 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 2 American Mineralogist, 2014, 99, 2-7 |
9016976 | CIF | C2 H4.38 Ca O6.19 | I 4/m | 12.3462; 12.3462; 7.3535 90; 90; 90 | 1120.88 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 3 American Mineralogist, 2014, 99, 2-7 |
9016977 | CIF | C2 H4.39 Ca O6.195 | I 4/m | 12.353; 12.353; 7.3594 90; 90; 90 | 1123.02 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 4 American Mineralogist, 2014, 99, 2-7 |
9016978 | CIF | C2 H4.4 Ca O6.2 | I 4/m | 12.3528; 12.3528; 7.3569 90; 90; 90 | 1122.6 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 5 American Mineralogist, 2014, 99, 2-7 |
9016979 | CIF | C2 H4.39 Ca O6.195 | I 4/m | 12.3542; 12.3542; 7.3604 90; 90; 90 | 1123.39 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 6 American Mineralogist, 2014, 99, 2-7 |
9016980 | CIF | C2 H4.47 Ca O6.235 | I 4/m | 12.3565; 12.3565; 7.3592 90; 90; 90 | 1123.62 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 7 American Mineralogist, 2014, 99, 2-7 |
9016981 | CIF | C2 H4.43 Ca O6.215 | I 4/m | 12.3443; 12.3443; 7.3599 90; 90; 90 | 1121.51 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 8 American Mineralogist, 2014, 99, 2-7 |
9016982 | CIF | C2 H4.46 Ca O6.23 | I 4/m | 12.3573; 12.3573; 7.3587 90; 90; 90 | 1123.69 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 9 American Mineralogist, 2014, 99, 2-7 |
9016983 | CIF | C2 H4.39 Ca O6.195 | I 4/m | 12.3558; 12.3558; 7.3601 90; 90; 90 | 1123.64 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 10 American Mineralogist, 2014, 99, 2-7 |
9016984 | CIF | C2 H4.52 Ca O6.26 | I 4/m | 12.3576; 12.3576; 7.3578 90; 90; 90 | 1123.61 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 11 American Mineralogist, 2014, 99, 2-7 |
9016985 | CIF | C2 H4.51 Ca O6.255 | I 4/m | 12.3567; 12.3567; 7.3573 90; 90; 90 | 1123.37 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 12 American Mineralogist, 2014, 99, 2-7 |
9016986 | CIF | C2 H4.52 Ca O6.26 | I 4/m | 12.3622; 12.3622; 7.3603 90; 90; 90 | 1124.83 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 13 American Mineralogist, 2014, 99, 2-7 |
9016987 | CIF | C2 H4.54 Ca O6.27 | I 4/m | 12.363; 12.363; 7.346 90; 90; 90 | 1122.79 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 14 American Mineralogist, 2014, 99, 2-7 |
9016988 | CIF | C2 H4.55 Ca O6.275 | I 4/m | 12.362; 12.362; 7.3574 90; 90; 90 | 1124.35 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 15 American Mineralogist, 2014, 99, 2-7 |
9016989 | CIF | C2 H4.58 Ca O6.29 | I 4/m | 12.3627; 12.3627; 7.3574 90; 90; 90 | 1124.48 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 16 American Mineralogist, 2014, 99, 2-7 |
9016990 | CIF | C2 H4.69 Ca O6.345 | I 4/m | 12.3783; 12.3783; 7.3659 90; 90; 90 | 1128.62 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 17 American Mineralogist, 2014, 99, 2-7 |
9016991 | CIF | Mg2 O4 Si | P b n m | 4.5232; 9.274; 5.5467 90; 90; 90 | 232.674 | Finkelstein, G. J.; Dera, P. K.; Jahn, S.; Oganov, A. R.; Holl, C. M.; Meng, Y.; Duffy, T. S. Phase transitions and equation of state of forsterite to 90 GPa from single-crystal X-ray diffraction and molecular modeling Note: P = 45.3 GPa American Mineralogist, 2014, 99, 35-43 |
9016992 | CIF | Mg2 O4 Si | P 1 | 4.695; 9.201; 5.311 93.1; 107.264; 98.133 | 215.766 | Finkelstein, G. J.; Dera, P. K.; Jahn, S.; Oganov, A. R.; Holl, C. M.; Meng, Y.; Duffy, T. S. Phase transitions and equation of state of forsterite to 90 GPa from single-crystal X-ray diffraction and molecular modeling Note: P = 52.4 GPa American Mineralogist, 2014, 99, 35-43 |
9016993 | CIF | Mg2 O4 Si | C m c 21 | 2.64; 8.596; 9.04 90; 90; 90 | 205.149 | Finkelstein, G. J.; Dera, P. K.; Jahn, S.; Oganov, A. R.; Holl, C. M.; Meng, Y.; Duffy, T. S. Phase transitions and equation of state of forsterite to 90 GPa from single-crystal X-ray diffraction and molecular modeling Note: P = 58.2 GPa American Mineralogist, 2014, 99, 35-43 |
9016994 | CIF | Mg2 O4 Si | C m c 21 | 2.591; 8.726; 8.794 90; 90; 90 | 198.824 | Finkelstein, G. J.; Dera, P. K.; Jahn, S.; Oganov, A. R.; Holl, C. M.; Meng, Y.; Duffy, T. S. Phase transitions and equation of state of forsterite to 90 GPa from single-crystal X-ray diffraction and molecular modeling Note: DFT Optimized Note: P = 58.2 GPa American Mineralogist, 2014, 99, 35-43 |
9016995 | CIF | Al3.544 Ca1.303 Ce2.697 Fe0.456 H2 O22 Si5 | P 1 21/m 1 | 8.9277; 5.6548; 17.587 90; 116.475; 90 | 794.757 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST4_11 American Mineralogist, 2014, 99, 157-169 |
9016996 | CIF | Al3.433 Ca1.225 Ce2.775 Fe0.567 H2 O22 Si5 | P 1 21/m 1 | 8.931; 5.6574; 17.6 90; 116.517; 90 | 795.713 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST4_09 American Mineralogist, 2014, 99, 157-169 |
9016997 | CIF | Al3.476 Ca1.211 Ce2.789 Fe0.524 H2 O22 Si5 | P 1 21/m 1 | 8.9205; 5.6573; 17.5715 90; 116.5; 90 | 793.594 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST3_01 American Mineralogist, 2014, 99, 157-169 |
9016998 | CIF | Al3.395 Ca1.21 Ce2.79 Fe0.605 H2 O22 Si5 | P 1 21/m 1 | 8.9546; 5.6675; 17.652 90; 116.677; 90 | 800.482 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: NE_01 American Mineralogist, 2014, 99, 157-169 |
9016999 | CIF | Al3.418 Ca1.146 Ce2.854 Fe0.582 H2 O22 Si5 | P 1 21/m 1 | 8.9222; 5.665; 17.569 90; 116.47; 90 | 794.92 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST4_10 American Mineralogist, 2014, 99, 157-169 |
9017000 | CIF | Al3.374 Ca1.108 Ce2.892 Fe0.626 H2 O22 Si5 | P 1 21/m 1 | 8.9165; 5.6754; 17.5253 90; 116.321; 90 | 794.916 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST4_02 American Mineralogist, 2014, 99, 157-169 |
9017001 | CIF | Al3.283 Ca1.119 Ce2.881 Fe0.717 H2 O22 Si5 | P 1 21/m 1 | 8.9327; 5.6817; 17.5807 90; 116.465; 90 | 798.768 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_01 American Mineralogist, 2014, 99, 157-169 |
9017002 | CIF | Al3.23 Ca1.11 Ce2.89 Fe0.77 H2 O22 Si5 | P 1 21/m 1 | 8.9313; 5.6608; 17.549 90; 116.396; 90 | 794.746 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_03 American Mineralogist, 2014, 99, 157-169 |
9017003 | CIF | Al3.221 Ca1.072 Ce2.928 Fe0.779 H2 O22 Si5 | P 1 21/m 1 | 8.911; 5.6866; 17.5252 90; 116.3; 90 | 796.133 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: HU_02 American Mineralogist, 2014, 99, 157-169 |
9017004 | CIF | Al3.197 Ca1.079 Ce2.921 Fe0.803 H2 O22 Si5 | P 1 21/m 1 | 8.8996; 5.6759; 17.5154 90; 116.221; 90 | 793.715 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_04 American Mineralogist, 2014, 99, 157-169 |
9017005 | CIF | Al3.15 Ca1.092 Ce2.908 Fe0.85 H2 O22 Si5 | P 1 21/m 1 | 8.895; 5.6827; 17.5044 90; 116.24; 90 | 793.626 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: HU_01 American Mineralogist, 2014, 99, 157-169 |
9017006 | CIF | Al3.252 Ca1.105 Ce2.895 Fe0.748 H2 O22 Si5 | P 1 21/m 1 | 8.9039; 5.6785; 17.5039 90; 116.301; 90 | 793.394 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02 American Mineralogist, 2014, 99, 157-169 |
9017007 | CIF | Al3.273 Ca1.115 Ce2.885 Fe0.727 H2 O22 Si5 | P 1 21/m 1 | 8.9044; 5.665; 17.5261 90; 116.399; 90 | 791.885 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-350, annealed for 48 hours at 350 C American Mineralogist, 2014, 99, 157-169 |
9017008 | CIF | Al3.229 Ca1.098 Ce2.902 Fe0.771 H2 O22 Si5 | P 1 21/m 1 | 8.9002; 5.6304; 17.7324 90; 116.71; 90 | 793.781 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-450, annealed for 48 hours at 450 C American Mineralogist, 2014, 99, 157-169 |
9017009 | CIF | Al3.233 Ca1.11 Ce2.89 Fe0.767 H2 O22 Si5 | P 1 21/m 1 | 8.9031; 5.629; 17.7392 90; 116.752; 90 | 793.853 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-550, annealed for 48 hours at 550 C American Mineralogist, 2014, 99, 157-169 |
9017010 | CIF | Al3.234 Ca1.098 Ce2.902 Fe0.766 H2 O22 Si5 | P 1 21/m 1 | 8.8979; 5.6235; 17.731 90; 116.815; 90 | 791.808 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-650, annealed for 48 hours at 650 C American Mineralogist, 2014, 99, 157-169 |
9017011 | CIF | Al3.232 Ca1.091 Ce2.909 Fe0.768 H2 O22 Si5 | P 1 21/m 1 | 8.8936; 5.6189; 17.755 90; 116.952; 90 | 790.889 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-750, annealed for 48 hours at 750 C American Mineralogist, 2014, 99, 157-169 |
9017012 | CIF | O2 Pb | P n a m | 5.493; 6.52; 3.453 90; 90; 90 | 123.667 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 23.5 GPa American Mineralogist, 2014, 99, 170-177 |
9017013 | CIF | O2 Pb | P n a m | 5.464; 6.468; 3.415 90; 90; 90 | 120.69 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 29.0 GPa American Mineralogist, 2014, 99, 170-177 |
9017014 | CIF | O2 Pb | P n a m | 5.426; 6.389; 3.362 90; 90; 90 | 116.549 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 39.0 GPa American Mineralogist, 2014, 99, 170-177 |
9017015 | CIF | O2 Pb | P n a m | 5.343; 6.29; 3.295 90; 90; 90 | 110.737 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 62.7 GPa American Mineralogist, 2014, 99, 170-177 |
9017016 | CIF | O2 Pb | P n a m | 5.298; 6.239; 3.269 90; 90; 90 | 108.054 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 75.1 GPa American Mineralogist, 2014, 99, 170-177 |
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