Crystallography Open Database
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Searching journal of publication like 'Journal of Applied Crystallography'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1000032 | CIF | Al2 O3 | R -3 c :H | 4.7605; 4.7605; 12.9956 90; 90; 120 | 255.1 | Lutterotti, L; Scardi, P Simultaneous structure and size-strain refinement by the Rietveld method Journal of Applied Crystallography, 1990, 23, 246-252 |
| 1001306 | CIF | Ge2 N2 O | C m c 21 | 9.317; 5.752; 5.105 90; 90; 90 | 273.6 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001307 | CIF | Ge2 N2 O | C m c 21 | 9.315; 5.747; 5.102 90; 90; 90 | 273.1 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001308 | CIF | Ge2 N2 O | C m c 21 | 9.306; 5.742; 5.097 90; 90; 90 | 272.4 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001309 | CIF | Ge2 N2 O | C m c 21 | 9.298; 5.736; 5.092 90; 90; 90 | 271.6 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001310 | CIF | Ge2 N2 O | C m c 21 | 9.287; 5.731; 5.089 90; 90; 90 | 270.9 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001311 | CIF | Ge2 N2 O | C m c 21 | 9.274; 5.727; 5.085 90; 90; 90 | 270.1 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001312 | CIF | Ge2 N2 O | C m c 21 | 9.266; 5.72; 5.08 90; 90; 90 | 269.2 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001313 | CIF | Ge2 N2 O | C m c 21 | 9.259; 5.714; 5.075 90; 90; 90 | 268.5 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001314 | CIF | Ge2 N2 O | C m c 21 | 9.261; 5.707; 5.074 90; 90; 90 | 268.2 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001315 | CIF | Ge2 N2 O | C m c 21 | 9.254; 5.699; 5.073 90; 90; 90 | 267.5 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1001316 | CIF | Ge2 N2 O | C m c 21 | 9.247; 5.689; 5.072 90; 90; 90 | 266.8 | Srinivasa, S R; Cartz, L; Jorgensen, J D; Labbe, J C Pressure-induced tetrahedral tilting and deformation in Ge~2~ N~2~ O Journal of Applied Crystallography, 1979, 12, 511-516 |
| 1004020 | CIF | Ca O3 Sn | R -3 :R | 6; 6; 6 54.42; 54.42; 54.42 | 132.9 | Durand, B; Loiseleur, H Crystal data for an ilmenite variety of calcium stannate Ca Sn O~3~ Journal of Applied Crystallography, 1978, 11, 289-290 |
| 1008036 | CIF | Cu O4 W | P -1 | 4.6964; 5.8287; 4.8736 91.63; 92.44; 82.79 | 132.2 | Klein, S; Weitzel, H Pernod - ein Programm zur Verfeinerung von Kristall-Strukturparametern aus Neutronenbeugungspulverdiagrammen Journal of Applied Crystallography, 1975, 8, 54-59 |
| 1100041 | CIF | N0.61 Ti | I 41/a m d :1 | 4.198; 4.198; 8.591 90; 90; 90 | 151.4 | Nagakura, S; Kusunoki, T Structure of Ti Nx studied by electron diffraction and microscopy Journal of Applied Crystallography, 1977, 10, 52-56 |
| 2300000 | CIF | C6 H6 B Br O2 | P 1 21/c 1 | 15.7797; 5.3085; 9.3757 90; 93.357; 90 | 784.02 | Nattamai S. P. Bhuvanesh; Joseph H. Reibenspies; Peter L. Lee; Yuegang Zhang A novel strategy for <i>ab initio</i> structure determination using micro-powder X-ray diffraction: structure solution and refinement of 3-bromophenylboronic acid and tris(4-bromophenyl)boroxine Journal of Applied Crystallography, 2005, 38, 632-638 |
| 2300001 | CIF | C18 H12 B3 Br3 O3 | P n m a | 18.9289; 21.8872; 4.8842 90; 90; 90 | 2023.53 | Nattamai S. P. Bhuvanesh; Joseph H. Reibenspies; Peter L. Lee; Yuegang Zhang A novel strategy for <i>ab initio</i> structure determination using micro-powder X-ray diffraction: structure solution and refinement of 3-bromophenylboronic acid and tris(4-bromophenyl)boroxine Journal of Applied Crystallography, 2005, 38, 632-638 |
| 2300002 | CIF | Ca0.816 Co0.28 Cu0.72 O2 | ?P? | 2.7954; 6.3078; 10.6017 90; 90; 90 | 186.938 | Dominique Grebille; Sebastien Lambert; Francoise Bouree; Vaclav Petricek Contribution of powder diffraction for structure refinements of aperiodic misfit cobalt oxides Journal of Applied Crystallography, 2004, 37, 823-831 |
| 2300003 | CIF HKL | H6 O9 P2 Sr | P -1 | 5.7491; 6.4104; 12.1002 93.56; 95.542; 114.013 | 402.91 | Bolte, Michael <i>TWINLAW</i> and <i>HKLF</i>5: two programs for the handling of non-merohedral twins Journal of Applied Crystallography, 2004, 37, 162-165 |
| 2300004 | CIF HKL | C2 H2 N4 O3 | P 1 21/c 1 | 9.3129; 5.4458; 9.0261 90; 101.464; 90 | 448.64 | Bolotina, Nadezhda B.; Zhurova, Elizabeth; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structure of β-NTO Journal of Applied Crystallography, 2003, 36, 280-285 |
| 2300005 | CIF HKL | C2 H2 N4 O3 | P 1 21/c 1 | 9.3185; 5.4615; 9.0475 90; 101.332; 90 | 451.48 | Bolotina, Nadezhda B.; Zhurova, Elizabeth; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structure of β-NTO Journal of Applied Crystallography, 2003, 36, 280-285 |
| 2300006 | CIF HKL | C2 H2 N4 O3 | P 1 21/c 1 | 9.322; 5.4791; 9.0685 90; 101.182; 90 | 454.39 | Bolotina, Nadezhda B.; Zhurova, Elizabeth; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structure of β-NTO Journal of Applied Crystallography, 2003, 36, 280-285 |
| 2300007 | CIF HKL | C2 H2 N4 O3 | P 1 21/c 1 | 9.3233; 5.4977; 9.0885 90; 101.019; 90 | 457.26 | Bolotina, Nadezhda B.; Zhurova, Elizabeth; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structure of β-NTO Journal of Applied Crystallography, 2003, 36, 280-285 |
| 2300008 | CIF HKL | C2 H2 N4 O3 | P 1 21/c 1 | 9.3207; 5.5215; 9.1102 90; 100.87; 90 | 460.44 | Bolotina, Nadezhda B.; Zhurova, Elizabeth; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structure of β-NTO Journal of Applied Crystallography, 2003, 36, 280-285 |
| 2300009 | CIF | C2 H8 N8 O4 | P -1 | 4.2928; 9.3043; 10.5438 85.236; 82.032; 81.19 | 411.326 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300010 | CIF | C2 H8 N8 O4 | P -1 | 4.3114; 9.3227; 10.5781 84.918; 81.686; 80.928 | 414.5 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300011 | CIF | C2 H8 N8 O4 | P -1 | 4.3312; 9.3456; 10.622 84.541; 81.285; 80.632 | 418.23 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300012 | CIF | C2 H8 N8 O4 | P -1 | 4.3535; 9.3742; 10.6783 84.072; 80.834; 80.273 | 422.73 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300013 | CIF | C2 H8 N8 O4 | P -1 | 4.3738; 9.4027; 10.7433 83.518; 80.343; 79.867 | 427.18 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300014 | CIF | C2 H9 N11 O8 | C 1 2/c 1 | 11.6824; 8.145; 13.0023 90; 117.407; 90 | 1098.34 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300015 | CIF | C2 H9 N11 O8 | C 1 2/c 1 | 11.7008; 8.1485; 13.0111 90; 117.337; 90 | 1101.99 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300016 | CIF | C2 H9 N11 O8 | C 1 2/c 1 | 11.7551; 8.1557; 13.0302 90; 117.005; 90 | 1113.01 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300017 | CIF | C2 H9 N11 O8 | C 1 2/c 1 | 11.7973; 8.1492; 13.0286 90; 116.639; 90 | 1119.59 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300018 | CIF | C2 H9 N11 O8 | C 1 2/c 1 | 11.8391; 8.1392; 13.0265 90; 116.225; 90 | 1126.04 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300019 | CIF | C4 H18 N22 O16 | C 1 2/c 1 | 11.8959; 8.1349; 13.0359 90; 115.806; 90 | 1135.7 | Bolotina, Nadezhda B.; Hardie, Michaele J.; Pinkerton, A. Alan Energetic materials: variable-temperature crystal structures of two biguanidinium dinitramides Journal of Applied Crystallography, 2003, 36, 1334-1341 |
| 2300020 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 13.2272; 8.1692; 14.892 90; 109.164; 90 | 1520 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300021 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 13.167; 8.1676; 14.8436 90; 109.001; 90 | 1509.34 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300022 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 13.1156; 8.1713; 14.8059 90; 108.841; 90 | 1501.75 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300023 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 13.0698; 8.1737; 14.7718 90; 108.696; 90 | 1494.78 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300024 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 13.0342; 8.1773; 14.7465 90; 108.566; 90 | 1489.95 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300025 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 8.8628; 12.5928; 13.3947 90; 106.92; 90 | 1430.2 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300026 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 8.8408; 12.5622; 13.3577 90; 106.82; 90 | 1420 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300027 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 8.8212; 12.5368; 13.333 90; 106.74; 90 | 1412 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300028 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 8.8004; 12.4992; 13.2985 90; 106.622; 90 | 1401.7 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300029 | CIF | C6 H6 N12 O12 | P 1 21/n 1 | 8.791; 12.481; 13.285 90; 106.55; 90 | 1397.2 | Journal of Applied Crystallography, 2004, 37, 791-797 |
| 2300030 | CIF | Fe Ni0.5 O4 P | P 1 21/c 1 | 5.98709; 4.72008; 10.357 90; 90.8913; 90 | 292.649 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300031 | CIF | Fe Ni0.5 O4 P | P 1 21/c 1 | 5.987146; 4.720383; 10.35681 90; 90.8902; 90 | 292.665 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300032 | CIF | Fe Ni0.5 O4 P | P 1 21/c 1 | 5.98729; 4.71923; 10.35671 90; 90.8886; 90 | 292.598 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300033 | CIF | Fe3 O8 P2 | P 1 21/c 1 | 8.8828; 11.1738; 6.14402 90; 99.348; 90 | 601.72 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300034 | CIF | Fe2 O7 P2 | C -1 | 6.643; 8.447; 4.495 90.43; 103.8; 92.49 | 244.7 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300035 | CIF | Fe Ni0.5 O4 P | P 1 21/c 1 | 5.98701; 4.719891; 10.35657 90; 90.8909; 90 | 292.621 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300036 | CIF | Co0.5 Fe O4 P | P 1 21/c 1 | 5.98701; 4.719891; 10.35657 90; 90.8909; 90 | 292.621 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300037 | CIF | Cu0.5 Fe O4 P | P 1 21/c 1 | 5.98701; 4.719891; 10.35657 90; 90.8909; 90 | 292.621 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300038 | CIF | Ni3 O8 P2 | P 1 21/c 1 | 5.83104; 4.69778; 10.1098 90; 91.1288; 90 | 276.883 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300039 | CIF | Ni2 O7 P2 | B 21/c | 13.1459; 8.2711; 8.9714 90; 104.949; 90 | 942.5 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300040 | CIF | Fe Ni0.5 O4 P | P 1 21/c 1 | 5.994351; 4.724935; 10.369383 90; 90.891; 90 | 293.656 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction Journal of Applied Crystallography, 2003, 36, 1361-1367 |
| 2300041 | CIF | Ag7 Cl O12 | F m -3 m | 9.955; 9.955; 9.955 90; 90; 90 | 986.5 | Journal of Applied Crystallography, 2004, 37, 318-324 |
| 2300042 | CIF | C2 H4 O2 | P 1 21/n 1 | 3.9447; 13.028; 5.6407 90; 93.177; 90 | 289.44 | Dawson, Alice; Allan, David R.; Parsons, Simon; Ruf, Michael Use of a CCD diffractometer in crystal structure determinations at high pressure Journal of Applied Crystallography, 2004, 37, 410-416 |
| 2300043 | CIF | C19 H13 N5 O5 | P 1 21 1 | 11.72; 6.831; 11.045 90; 94.38; 90 | 881.7 | Chernyshev, Vladimir V.; Yatsenko, Alexandr V.; Kuvshinov, Alexandr M.; Shevelev, Svyatoslav A. Unexpected molecular structure from laboratory powder diffraction data Journal of Applied Crystallography, 2002, 35, 669-673 |
| 2300044 | CIF | C21 H17 N5 O7 | P 21 21 21 | 22.788; 13.018; 6.92 90; 90; 90 | 2052.8 | Chernyshev, Vladimir V.; Yatsenko, Alexandr V.; Kuvshinov, Alexandr M.; Shevelev, Svyatoslav A. Unexpected molecular structure from laboratory powder diffraction data Journal of Applied Crystallography, 2002, 35, 669-673 |
| 2300045 | CIF | C20 H15 N5 O5 | P 1 21/c 1 | 8.676; 18.56; 12.098 90; 90.38; 90 | 1948.1 | Chernyshev, Vladimir V.; Yatsenko, Alexandr V.; Kuvshinov, Alexandr M.; Shevelev, Svyatoslav A. Unexpected molecular structure from laboratory powder diffraction data Journal of Applied Crystallography, 2002, 35, 669-673 |
| 2300046 | CIF | C6 H14 O6 | P 21 21 2 | 24.30122; 20.57261; 4.86719 90; 90; 90 | 2433.3 | Rukiah, Mwaffak; Lefebvre, Jacques; Hernandez, Olivier; van Beek, Wouter; Serpelloni, Michel Ab initiostructure determination of the Γ form of D-sorbitol (D-glucitol) by powder synchrotron X-ray diffraction Journal of Applied Crystallography, 2004, 37, 766-772 |
| 2300047 | CIF HKL | C18 H18 Fe O | C 1 2 1 | 29.033; 5.943; 16.753 90; 90.562; 90 | 2890.5 | T. Koganezawa; K. Uno; H. Iwasaki; N. Nakamura; Y. Yoshimura; T. Shoji A wide-bandpass multilayer monochromator and its application to the determination of absolute structure Journal of Applied Crystallography, 2004, 37, 136-142 |
| 2300048 | CIF HKL | C18 H18 Fe O | C 1 2 1 | 29.042; 5.946; 16.753 90; 90.587; 90 | 2892.8 | T. Koganezawa; K. Uno; H. Iwasaki; N. Nakamura; Y. Yoshimura; T. Shoji A wide-bandpass multilayer monochromator and its application to the determination of absolute structure Journal of Applied Crystallography, 2004, 37, 136-142 |
| 2300049 | CIF | Ce0.4 Gd0.6 O1.7 | I a -3 | 10.8542; 10.8542; 10.8542 90; 90; 90 | 1278.77 | V. Grover; S. N. Achary; A. K. Tyagi Structural analysis of excess-anion C-type rare earth oxide: a case study with Gd~1{-~<i>x</i>}Ce~<i>x~</i>O~1.5+<i>x~/2</i> (<i>x</i> = 0.20 and 0.40) Journal of Applied Crystallography, 2003, 36, 1082-1084 |
| 2300050 | CIF | Ce0.2 Gd0.8 O1.6 | I a -3 | 10.8488; 10.8488; 10.8488 90; 90; 90 | 1276.87 | V. Grover; S. N. Achary; A. K. Tyagi Structural analysis of excess-anion C-type rare earth oxide: a case study with Gd~1{-~<i>x</i>}Ce~<i>x~</i>O~1.5+<i>x~/2</i> (<i>x</i> = 0.20 and 0.40) Journal of Applied Crystallography, 2003, 36, 1082-1084 |
| 2300051 | CIF | C24 H48 B2 F8 N24 Zn | R -3 :H | 10.8429; 10.8429; 31.607 90; 90; 120 | 3218.1 | Hartmunt Spiering; Philipp Gutlich The deformation tensor ε of the spin transition in the mixed crystal [Fe~0.46~Zn~0.54~(ptz)~6~](BF~4~)~2~ Journal of Applied Crystallography, 2004, 37, 589-595 |
| 2300052 | CIF | C24 H48 B2 F8 Fe N24 | R -3 :H | 10.881; 10.881; 31.48 90; 90; 120 | 3227.8 | Kusz, Joachim; Spiering, Hartmut; Gütlich, Philipp The deformation tensor ε of the spin transition in the mixed crystal [Fe~0.46~Zn~0.54~(ptz)~6~](BF~4~)~2~ Journal of Applied Crystallography, 2004, 37, 589-595 |
| 2300053 | CIF | C24 H48 B2 F8 Fe N24 | R -3 :H | 10.701; 10.701; 31.9 90; 90; 120 | 3163.5 | Kusz, Joachim; Spiering, Hartmut; Gütlich, Philipp The deformation tensor ε of the spin transition in the mixed crystal [Fe~0.46~Zn~0.54~(ptz)~6~](BF~4~)~2~ Journal of Applied Crystallography, 2004, 37, 589-595 |
| 2300054 | CIF | C24 H48 B2 F8 Fe0.46 N24 Zn0.54 | R -3 :H | 10.8575; 10.8575; 31.56 90; 90; 120 | 3222 | Kusz, Joachim; Spiering, Hartmut; Gütlich, Philipp The deformation tensor ε of the spin transition in the mixed crystal [Fe~0.46~Zn~0.54~(ptz)~6~](BF~4~)~2~ Journal of Applied Crystallography, 2004, 37, 589-595 |
| 2300055 | CIF | C24 H48 B2 F8 Fe0.46 N24 Zn0.54 | R -3 :H | 10.7719; 10.7719; 31.763 90; 90; 120 | 3191.8 | Kusz, Joachim; Spiering, Hartmut; Gütlich, Philipp The deformation tensor ε of the spin transition in the mixed crystal [Fe~0.46~Zn~0.54~(ptz)~6~](BF~4~)~2~ Journal of Applied Crystallography, 2004, 37, 589-595 |
| 2300056 | CIF | O Pb Sc Ta | F m -3 m | 8.15231; 8.15231; 8.15231 90; 90; 90 | 541.804 | Woodward, P. M.; Baba-Kishi, K. Z. Crystal structures of the relaxor oxide Pb~2~(ScTa)O~6~ in the paraelectric and ferroelectric states Journal of Applied Crystallography, 2002, 35, 233-242 |
| 2300057 | CIF | C32 H53 N3 O6 | ?P? | 61.0155; 11.1836; 5.0827 90; 90; 90 | 3468.3 | Brenner, Simon; McCusker, Lynne B.; Baerlocher, Christian The application of structure envelopes in structure determination from powder diffraction data Journal of Applied Crystallography, 2002, 35, 243-252 |
| 2300058 | CIF | C8 H15 N7 O2 S3 | P 1 21/c 1 | 17.6547; 5.2932; 18.259 90; 123.558; 90 | 1421.91 | Shankland, Kenneth; McBride, Lorraine; David, William I. F.; Shankland, Norman; Steele, Gerald Molecular, crystallographic and algorithmic factors in structure determination from powder diffraction data by simulated annealing Journal of Applied Crystallography, 2002, 35, 443-454 |
| 2300059 | CIF | C14 H11 Cl2 N O2 | C 1 2/c 1 | 20.2906; 6.9952; 20.1137 90; 109.663; 90 | 2688.4 | Muangsin, Nongnuj; Prajuabsook, Malee; Chimsook, Pitiporn; Chantarasiri, Nuanphun; Siraleartmukul, Krisana; Chaichit, Narongsak; Hannongbua, Supot Structure determination of diclofenac in a diclofenac-containing chitosan matrix using conventional X-ray powder diffraction data Journal of Applied Crystallography, 2004, 37, 288-294 |
| 2300060 | CIF | C14 H11 Cl2 N O2 | C 1 2/c 1 | 20.298; 6.993; 20.107 90; 109.6; 90 | 2688.7 | Muangsin, Nongnuj; Prajuabsook, Malee; Chimsook, Pitiporn; Chantarasiri, Nuanphun; Siraleartmukul, Krisana; Chaichit, Narongsak; Hannongbua, Supot Structure determination of diclofenac in a diclofenac-containing chitosan matrix using conventional X-ray powder diffraction data Journal of Applied Crystallography, 2004, 37, 288-294 |
| 2300061 | CIF | C Fe3 | P n m a | 5.08493; 6.73631; 4.514 90; 90; 90 | 154.621 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600 K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300062 | CIF | C Fe3 | P n m a | 5.08524; 6.7362; 4.51431 90; 90; 90 | 154.638 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600 K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300063 | CIF | C Fe3 | P n m a | 5.08475; 6.7367; 4.51394 90; 90; 90 | 154.622 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600 K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300064 | CIF | C Fe3 | P n m a | 5.08442; 6.7376; 4.51384 90; 90; 90 | 154.63 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300065 | CIF | C Fe3 | P n m a | 5.08429; 6.7387; 4.51363 90; 90; 90 | 154.644 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300066 | CIF | C Fe3 | P n m a | 5.08412; 6.7404; 4.51364 90; 90; 90 | 154.678 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300067 | CIF | C Fe3 | P n m a | 5.08394; 6.7418; 4.51359 90; 90; 90 | 154.703 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300068 | CIF | C Fe3 | P n m a | 5.08396; 6.7433; 4.51368 90; 90; 90 | 154.741 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300069 | CIF | C Fe3 | P n m a | 5.08416; 6.7453; 4.51394 90; 90; 90 | 154.802 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300070 | CIF | C Fe3 | P n m a | 5.084; 6.7469; 4.51405 90; 90; 90 | 154.838 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300071 | CIF | C Fe3 | P n m a | 5.08411; 6.7483; 4.51457 90; 90; 90 | 154.891 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300072 | CIF | C Fe3 | P n m a | 5.08426; 6.7498; 4.51509 90; 90; 90 | 154.948 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300073 | CIF | C Fe3 | P n m a | 5.0843; 6.7513; 4.51556 90; 90; 90 | 154.999 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300074 | CIF | C Fe3 | P n m a | 5.0842; 6.753; 4.51621 90; 90; 90 | 155.058 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300075 | CIF | C Fe3 | P n m a | 5.08398; 6.7547; 4.5165 90; 90; 90 | 155.1 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300076 | CIF | C Fe3 | P n m a | 5.08395; 6.7558; 4.51728 90; 90; 90 | 155.151 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300077 | CIF | C Fe3 | P n m a | 5.08369; 6.7574; 4.51789 90; 90; 90 | 155.201 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300078 | CIF | C Fe3 | P n m a | 5.0837; 6.7589; 4.51839 90; 90; 90 | 155.253 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300079 | CIF | C Fe3 | P n m a | 5.08334; 6.7599; 4.51926 90; 90; 90 | 155.295 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300080 | CIF | C Fe3 | P n m a | 5.08324; 6.7615; 4.51937 90; 90; 90 | 155.332 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300081 | CIF | C Fe3 | P n m a | 5.08247; 6.7626; 4.52013 90; 90; 90 | 155.36 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300082 | CIF | C Fe3 | P n m a | 5.08223; 6.7638; 4.52058 90; 90; 90 | 155.396 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300083 | CIF | C Fe3 | P n m a | 5.08134; 6.7655; 4.52039 90; 90; 90 | 155.401 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
| 2300084 | CIF | C Fe3 | P n m a | 5.08071; 6.767; 4.52047 90; 90; 90 | 155.419 | Wood, I. G.; Vočadlo, Lidunka; Knight, K. S.; Dobson, David P.; Marshall, W. G.; Price, G. David; Brodholt, John Thermal expansion and crystal structure of cementite, Fe~3~C, between 4 and 600K determined by time-of-flight neutron powder diffraction Journal of Applied Crystallography, 2004, 37, 82-90 |
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