Crystallography Open Database
Search results
Result: there are 753 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 | archive of CIF files (ZIP)
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 |
| 2300085 | CIF | C Fe3 | P n m a | 5.08104; 6.7689; 4.52139 90; 90; 90 | 155.504 | 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 |
| 2300086 | CIF | C Fe3 | P n m a | 5.08233; 6.7704; 4.52219 90; 90; 90 | 155.606 | 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 |
| 2300087 | CIF | C Fe3 | P n m a | 5.08326; 6.7732; 4.52326 90; 90; 90 | 155.736 | 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 |
| 2300088 | CIF | C Fe3 | P n m a | 5.08468; 6.7749; 4.52433 90; 90; 90 | 155.855 | 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 |
| 2300089 | CIF | C Fe3 | P n m a | 5.08644; 6.7772; 4.52559 90; 90; 90 | 156.005 | 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 |
| 2300090 | CIF | C Fe3 | P n m a | 5.08801; 6.7791; 4.52694 90; 90; 90 | 156.144 | 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 |
| 2300091 | CIF | C Fe3 | P n m a | 5.0899; 6.781; 4.52797 90; 90; 90 | 156.281 | 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 |
| 2300092 | CIF | Al Ca O5 Ta | P 1 21/n 1 | 6.6298; 8.9515; 7.3502 90; 113.792; 90 | 399.139 | Malcherek, Thomas; Borowski, Markus; Bosenick, Anne Structure and phase transitions of CaTaOAlO~4~ Journal of Applied Crystallography, 2004, 37, 117-122 |
| 2300093 | CIF | C20 H30 Cl2 Fe N6 O | P 1 21/c 1 | 10.8041; 21.6945; 11.395 90; 117.33; 90 | 2372.7 | Kusz, Joachim; Schollmeyer, Dieter; Spiering, Hartmunt; Gütlich, Philipp The LIESST state of [Fe(pic)~3~]Cl~2~.EtOH ‒ the superstructure under continuous irradiation Journal of Applied Crystallography, 2005, 38, 528-536 |
| 2300094 | CIF | C20 H30 Cl2 Fe N6 O | P 1 21/c 1 | 10.7098; 21.5711; 11.356 90; 116.62; 90 | 2345.4 | Kusz, Joachim; Schollmeyer, Dieter; Spiering, Hartmunt; Gütlich, Philipp The LIESST state of [Fe(pic)~3~]Cl~2~.EtOH ‒ the superstructure under continuous irradiation Journal of Applied Crystallography, 2005, 38, 528-536 |
| 2300095 | CIF | C20 H30 Cl2 Fe N6 O | P 1 21/c 1 | 10.9348; 21.9329; 11.484 90; 117.59; 90 | 2441 | Kusz, Joachim; Schollmeyer, Dieter; Spiering, Hartmunt; Gütlich, Philipp The LIESST state of [Fe(pic)~3~]Cl~2~.EtOH ‒ the superstructure under continuous irradiation Journal of Applied Crystallography, 2005, 38, 528-536 |
| 2300096 | CIF | C20 H30 Cl2 Fe N6 O | P 1 21/c 1 | 10.7322; 21.5055; 11.323 90; 117.184; 90 | 2324.7 | Kusz, Joachim; Schollmeyer, Dieter; Spiering, Hartmunt; Gütlich, Philipp The LIESST state of [Fe(pic)~3~]Cl~2~.EtOH ‒ the superstructure under continuous irradiation Journal of Applied Crystallography, 2005, 38, 528-536 |
| 2300097 | CIF | C40 H60 Cl4 Fe2 N12 O2 | P 1 21/n 1 | 21.608; 21.6945; 11.395 90; 117.33; 90 | 4745 | Kusz, Joachim; Schollmeyer, Dieter; Spiering, Hartmunt; Gütlich, Philipp The LIESST state of [Fe(pic)~3~]Cl~2~.EtOH ‒ the superstructure under continuous irradiation Journal of Applied Crystallography, 2005, 38, 528-536 |
| 2300098 | CIF | C20 H30 Cl2 Fe N6 O | P 1 21/c 1 | 10.949; 21.825; 11.37 90; 118.85; 90 | 2379.8 | Kusz, Joachim; Schollmeyer, Dieter; Spiering, Hartmunt; Gütlich, Philipp The LIESST state of [Fe(pic)~3~]Cl~2~.EtOH ‒ the superstructure under continuous irradiation Journal of Applied Crystallography, 2005, 38, 528-536 |
| 2300099 | CIF | K O8 W2 Yb | C 1 2/c 1 | 10.59; 10.29; 7.478 90; 130.7; 90 | 617.8 | M.C. Pujol; X. Mateos; R. Solé; J. Massons; Jna. Gavaldà; X. Solans; F. Diaz; M. Aguiló Structure, crystal growth and physical anisotropy of KYb(WO~4~)~2~, a new laser matrix Journal of Applied Crystallography, 2002, 35, 108-112 |
| 2300100 | CIF | C7 H9 N | P 1 21/c 1 | 24.8727; 5.80729; 8.7615 90; 100.062; 90 | 1246.07 | Lefebvre, Jacques; Descamps, Marc; Hemon, Stephanie; Dzyabchenko, Alexander Ab initio structure determination of meta-toluidine by powder X-ray diffraction Journal of Applied Crystallography, 2004, 37, 464-471 |
| 2300101 | CIF | Al2 Eu0.136 O4 Sr0.864 | P 63 2 2 | 5.11635; 5.11635; 8.3673 90; 90; 120 | 189.687 | Chao-Nan, Xu; Wen-Sheng Shi Observation of orientational disorder in the hexagonal stuffed tridymite Sr~0.864~Eu~0.136~Al~2~O~4~ by the maximum-entropy method Journal of Applied Crystallography, 2004, 37, 698-702 |
| 2300102 | CIF | C18 H15 O3 P | R -3 :H | 37.766; 37.766; 5.7286 90; 90; 120 | 7075.9 | Hernandez, Olivier; Hédoux, Alain; Lefebvre, Jacques; Guinet, Yannick; Descamps, Marc; Papoular, Robert; Masson, Olivier <i>Ab</i> <i>initio</i> structure determination of triphenyl phosphite by powder synchrotron X-ray diffraction Journal of Applied Crystallography, 2002, 35, 212-219 |
| 2300103 | CIF | C18 H22 Cu N8 O6 S2 | P 1 21/n 1 | 20.695; 8.054; 15.157 90; 112.09; 90 | 2340.9 | García-Cuesta, M. C.; Lozano, A. M.; Meléndez-Martínez, J. J.; Luna-Giles, F.; Ortiz, A. L.; González-Méndez, L. M.; Cumbrera, F. L. Structure determination of nitrato-κ<i>O</i>-bis[2-(2-pyridyl-κ<i>N</i>)amino-5,6-dihydro-4<i>H</i>-1,3-thiazine-κ<i>N</i>]copper(II) nitrate <i>via</i> molecular modelling coupled with X-ray powder diffractometry Journal of Applied Crystallography, 2004, 37, 993-999 |
| 2300110 | CIF Paper | ? | P 6/m m m | 30.960745; 30.960745; 7.519782 90; 90; 120 | 6242.5 | Foster, M. D.; Treacy, M. M. J.; Higgins, J. B.; Rivin, I.; Balkovsky, E.; Randall, K. H. A systematic topological search for the framework of ZSM-10 Journal of Applied Crystallography, 2005, 38, 1028-1030 |
| 2300111 | CIF | In2 Mn0.4 S4 Zn0.6 | R 3 m :H | 3.875218; 3.875218; 37.20846 90; 90; 120 | 483.91 | Ávila-Godoy, Rosario; Mora, Asiloé J.; Acosta-Najarro, Dwight R.; Delgado, Gerzon E.; López-Rivera, Santos A.; Fitch, Andrew N.; Mora, Andrés E.; Steeds, John W. Structure of the quaternary alloy Zn~0.6~Mn~0.4~In~2~S~4~ from synchrotron powder diffraction and electron transmission microscopy Journal of Applied Crystallography, 2006, 39, 1-5 |
| 2300112 | CIF Paper | O Zn | P 63 m c | 3.2494; 3.2494; 5.2054 90; 90; 120 | 47.598 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
| 2300113 | CIF Paper | O Zn | P 63 m c | 3.2342; 3.2342; 5.1772 90; 90; 120 | 46.899 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
| 2300114 | CIF Paper | O Zn | P 63 m c | 3.219; 3.219; 5.1489 90; 90; 120 | 46.205 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
| 2300115 | CIF Paper | O Zn | P 63 m c | 3.2049; 3.2049; 5.1216 90; 90; 120 | 45.558 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
| 2300116 | CIF Paper | O Zn | P 63 m c | 3.195; 3.195; 5.1027 90; 90; 120 | 45.11 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
| 2300117 | CIF Paper | K Lu O8 W2 | C 1 2/c 1 | 10.576; 10.214; 7.487 90; 130.68; 90 | 613.3 | Pujol, M. C.; Mateos, X.; Aznar, A.; Solans, X.; Suriñach, S.; Massons, J.; Díaz, F.; Aguiló, M. Structural redetermination, thermal expansion and refractive indices of KLu(WO~4~)~2~ Journal of Applied Crystallography, 2006, 39, 230-236 |
| 2300118 | CIF Paper | C H5 Cl Mg2 O6 | R 3 c :H | 23.14422; 23.14422; 7.22333 90; 90; 120 | 3350.84 | Sugimoto, Kunihisa; Dinnebier, Robert E.; Schlecht, Thomas Chlorartinite, a volcanic exhalation product also found in industrial magnesia screed Journal of Applied Crystallography, 2006, 39, 739-744 |
| 2300119 | CIF Paper | ? | P 21 21 21 | 6.88; 11.91; 18.6 90; 90; 90 | 1524.1 | Immirzi, Attilio; Alfano, Davide; Tedesco, Consiglia New solutions to the problems of chain orientation and chain continuity in structure analysis of fibrous polymers. A reconsideration of the structure of polyisobutene Journal of Applied Crystallography, 2007, 40, 10-15 |
| 2300120 | CIF HKL Paper | C24 H22 Fe2 N12 S8 | P -1 | 8.446; 9.123; 11.779 72.26; 80.94; 67.33 | 796.8 | Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches Journal of Applied Crystallography, 2007, 40, 158-164 |
| 2300121 | CIF HKL Paper | C24 H22 Fe2 N12 S8 | P -1 | 8.6103; 9.2628; 11.9305 72.903; 80.057; 66.911 | 834.84 | Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches Journal of Applied Crystallography, 2007, 40, 158-164 |
| 2300122 | CIF HKL Paper | C24 H22 Fe2 N12 S8 | P -1 | 8.727; 9.385; 12.041 73.04; 79.43; 66.6 | 863.1 | Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches Journal of Applied Crystallography, 2007, 40, 158-164 |
| 2300123 | CIF HKL Paper | C24 H22 Fe2 N12 S8 | P -1 | 8.581; 9.196; 11.948 73.34; 80.53; 67.24 | 831.4 | Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches Journal of Applied Crystallography, 2007, 40, 158-164 |
| 2300124 | CIF HKL Paper | C24 H22 Fe2 N12 S8 | P -1 | 8.642; 9.224; 12.05 73.63; 80.29; 67.25 | 848 | Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches Journal of Applied Crystallography, 2007, 40, 158-164 |
| 2300125 | CIF HKL | C20 H17 F O3 S | P 1 21/c 1 | 12.68581; 8.18939; 17.7934 90; 106.011; 90 | 1776.83 | Llinàs, Antonio; Box, Karl J.; Burley, Jonathan C.; Glen, Robert C.; Goodman, Jonathan M. A new method for the reproducible generation of polymorphs: two forms of sulindac with very different solubilities Journal of Applied Crystallography, 2007, 40, 379-381 |
| 2300126 | CIF HKL Paper | C20 H14 N2 O | I 41/a :2 | 21.5111; 21.5111; 13.2377 90; 90; 90 | 6125.4 | Zeng, He-Ping; Wang, Ting-Ting; Xu, Dan-Feng; Cai, Yue-Peng; Chen, Dong-Feng Synthesis, crystal structure and biological activity of 2-[2-(quinolin-2-yl)vinyl]-8-hydroxyquinoline and 2-[2-(quinolin-4-yl)vinyl]-8-hydroxyquinoline Journal of Applied Crystallography, 2007, 40, 471-475 |
| 2300127 | CIF HKL Paper | C20 H14 N2 O | P 1 21/n 1 | 10.724; 8.9019; 16.1894 90; 102.039; 90 | 1511.51 | Zeng, He-Ping; Wang, Ting-Ting; Xu, Dan-Feng; Cai, Yue-Peng; Chen, Dong-Feng Synthesis, crystal structure and biological activity of 2-[2-(quinolin-2-yl)vinyl]-8-hydroxyquinoline and 2-[2-(quinolin-4-yl)vinyl]-8-hydroxyquinoline Journal of Applied Crystallography, 2007, 40, 471-475 |
| 2300128 | CIF Paper | Mg O4 S | C m c m | 5.174713; 7.87563; 6.49517 90; 90; 90 | 264.705 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Brand, H. E. A.; Knight, K. S. Crystal structures and thermal expansion of α-MgSO~4~ and β-MgSO~4~ from 4.2 to 300K by neutron powder diffraction Journal of Applied Crystallography, 2007, 40, 761-770 |
| 2300129 | CIF Paper | Mg O4 S | C m c m | 5.168629; 7.86781; 6.46674 90; 90; 90 | 262.975 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Brand, H. E. A.; Knight, K. S. Crystal structures and thermal expansion of α-MgSO~4~ and β-MgSO~4~ from 4.2 to 300K by neutron powder diffraction Journal of Applied Crystallography, 2007, 40, 761-770 |
| 2300130 | CIF Paper | Mg O4 S | P b n m | 4.74599; 8.5831; 6.70934 90; 90; 90 | 273.307 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Brand, H. E. A.; Knight, K. S. Crystal structures and thermal expansion of α-MgSO~4~ and β-MgSO~4~ from 4.2 to 300K by neutron powder diffraction Journal of Applied Crystallography, 2007, 40, 761-770 |
| 2300131 | CIF Paper | Mg O4 S | P b n m | 4.73431; 8.58171; 6.67266 90; 90; 90 | 271.1 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Brand, H. E. A.; Knight, K. S. Crystal structures and thermal expansion of α-MgSO~4~ and β-MgSO~4~ from 4.2 to 300K by neutron powder diffraction Journal of Applied Crystallography, 2007, 40, 761-770 |
| 2300132 | CIF Paper | C40 H48 O8 | P 41 21 2 | 6.8558; 6.8558; 16.9375 90; 90; 90 | 796.096 | Brunelli, Michela; Neumann, Marcus A.; Fitch, Andrew N.; Mora, Asiloé J. Temperature phase changes in solid bicyclo[3.3.1]nonane-2,6-dione and bicyclo[3.3.1]nonane-3,7-dione from powder X-ray diffraction data Journal of Applied Crystallography, 2007, 40, 702-709 |
| 2300133 | CIF Paper | C34 H48 O8 | C 1 2/c 1 | 7.3803; 10.382; 9.7508 90; 95.359; 90 | 743.863 | Brunelli, Michela; Neumann, Marcus A.; Fitch, Andrew N.; Mora, Asiloé J. Temperature phase changes in solid bicyclo[3.3.1]nonane-2,6-dione and bicyclo[3.3.1]nonane-3,7-dione from powder X-ray diffraction data Journal of Applied Crystallography, 2007, 40, 702-709 |
| 2300134 | CIF Paper | ? | P -3 m 1 | 5.7523; 5.7523; 7.0634 90; 90; 120 | 202.408 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300135 | CIF | ? | P m -3 m | 4.07307; 4.07307; 4.07307 90; 90; 90 | 67.572 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300136 | CIF | ? | P -3 m 1 | 5.7657; 5.7657; 7.0444 90; 90; 120 | 202.81 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300137 | CIF | ? | P m -3 m | 4.07013; 4.07013; 4.07013 90; 90; 90 | 67.426 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300138 | CIF | ? | P -3 m 1 | 5.7532; 5.7532; 7.0641 90; 90; 120 | 202.491 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300139 | CIF | ? | P m -3 m | 4.07348; 4.07348; 4.07348 90; 90; 90 | 67.592 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300140 | CIF | ? | P -3 m 1 | 5.7675; 5.7675; 7.0567 90; 90; 120 | 203.29 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300141 | CIF | ? | P m -3 m | 4.0712; 4.0712; 4.0712 90; 90; 90 | 67.479 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300142 | CIF | ? | P -3 m 1 | 5.7893; 5.7893; 7.1158 90; 90; 120 | 206.54 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300143 | CIF | ? | P m -3 m | 4.07045; 4.07045; 4.07045 90; 90; 90 | 67.442 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300144 | CIF | ? | P -3 m 1 | 5.7665; 5.7665; 7.058 90; 90; 120 | 203.25 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300145 | CIF | ? | P m -3 m | 4.093113; 4.093113; 4.093113 90; 90; 90 | 68.5743 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300146 | CIF | ? | P m -3 m | 4.09518; 4.09518; 4.09518 90; 90; 90 | 68.678 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300147 | CIF | ? | P m -3 m | 4.07207; 4.07207; 4.07207 90; 90; 90 | 67.5221 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300148 | CIF | ? | P -3 m 1 | 5.74601; 5.74601; 7.06047 90; 90; 120 | 201.882 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300149 | CIF | ? | P -3 m 1 | 5.762; 5.762; 7.0764 90; 90; 120 | 203.46 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300150 | CIF | ? | P -3 m 1 | 5.7645; 5.7645; 7.092 90; 90; 120 | 204.09 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300151 | CIF | ? | P m -3 m | 4.06541; 4.06541; 4.06541 90; 90; 90 | 67.1913 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300152 | CIF | ? | P m -3 m | 4.06857; 4.06857; 4.06857 90; 90; 90 | 67.348 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300153 | CIF | ? | P m -3 m | 4.07191; 4.07191; 4.07191 90; 90; 90 | 67.514 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300154 | CIF | ? | P -3 m 1 | 5.7654; 5.7654; 7.091 90; 90; 120 | 204.13 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300155 | CIF | ? | P -3 m 1 | 5.74666; 5.74666; 7.05943 90; 90; 120 | 201.898 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300156 | CIF | ? | P -3 m 1 | 5.7462; 5.7462; 7.05894 90; 90; 120 | 201.851 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300158 | CIF | ? | P m -3 m | 4.06839634; 4.06839634; 4.06839634 90; 90; 90 | 67.339 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300159 | CIF | ? | P m -3 m | 4.066; 4.066; 4.066 90; 90; 90 | 67.2206 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300160 | CIF | ? | P -3 m 1 | 5.7981; 5.7981; 11.7947 90; 90; 120 | 343.39 | Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R. A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~ Journal of Applied Crystallography, 2007, 40, 749-755 |
| 2300161 | CIF Paper | Mn O3 Y | P 63 c m | 6.22215; 6.22215; 11.37072 90; 90; 120 | 381.241 | Jeong, Il-Kyoung; Hur, N.; Proffen, Th. High-temperature structural evolution of hexagonal multiferroic YMnO~3~ and YbMnO~3~ Journal of Applied Crystallography, 2007, 40, 730-734 |
| 2300162 | CIF Paper | Mn O3 Y | P 63/m m c | 3.63011; 3.63011; 11.3535 90; 90; 120 | 129.569 | Jeong, Il-Kyoung; Hur, N.; Proffen, Th. High-temperature structural evolution of hexagonal multiferroic YMnO~3~ and YbMnO~3~ Journal of Applied Crystallography, 2007, 40, 730-734 |
| 2300163 | CIF Paper | Mn O3 Yb | P 63 c m | 6.132019; 6.132019; 11.38556 90; 90; 120 | 370.759 | Jeong, Il-Kyoung; Hur, N.; Proffen, Th. High-temperature structural evolution of hexagonal multiferroic YMnO~3~ and YbMnO~3~ Journal of Applied Crystallography, 2007, 40, 730-734 |
| 2300164 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.1545; 19.0923; 15.0033 90; 91.566; 90 | 2907.64 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300165 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.1834; 19.072; 15.0304 90; 91.467; 90 | 2918.21 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300166 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.1952; 19.0901; 15.0429 90; 91.451; 90 | 2926.8 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300167 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.2122; 19.1179; 15.0573 90; 91.42; 90 | 2938.82 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300168 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.2327; 19.1464; 15.0753 90; 91.402; 90 | 2952.7 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300169 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.2747; 19.2019; 15.1011 90; 91.399; 90 | 2978.46 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300170 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.3663; 19.2603; 15.1373 90; 91.432; 90 | 3021.34 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300171 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.4678; 19.3228; 15.1695 90; 91.501; 90 | 3067.2 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300172 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.529; 19.3683; 15.1933 90; 91.541; 90 | 3097.2 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300173 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.5677; 19.4022; 15.2137 90; 91.564; 90 | 3118.2 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300174 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.6005; 19.4289; 15.2382 90; 91.595; 90 | 3137.2 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300175 | CIF | C27 H33 Cl2 Fe N7 O8 | P 1 21/c 1 | 10.6286; 19.4535; 15.2589 90; 91.626; 90 | 3153.7 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300176 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.3736; 19.1884; 15.1122 90; 91.885; 90 | 3006.5 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300177 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.4189; 19.2284; 15.1216 90; 91.726; 90 | 3028.07 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300178 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.4611; 19.2701; 15.132 90; 91.596; 90 | 3049.22 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300179 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.507; 19.3169; 15.1467 90; 91.492; 90 | 3073.2 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300180 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.5321; 19.3391; 15.1543 90; 91.468; 90 | 3085.63 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300181 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.5561; 19.3641; 15.1621 90; 91.441; 90 | 3098.3 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300182 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.5813; 19.3933; 15.1756 90; 91.429; 90 | 3113.16 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300183 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.625; 19.456; 15.22 90; 91.5; 90 | 3145.2 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300184 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.6308; 19.4519; 15.213 90; 91.451; 90 | 3144.9 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300185 | CIF | C27 H33 Cl2 N7 O8 Zn | P 1 21/c 1 | 10.6541; 19.4812; 15.2306 90; 91.478; 90 | 3160.1 | Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data Journal of Applied Crystallography, 2007, 40, 1135-1145 |
| 2300186 | CIF HKL Paper | C26 H16 Fe N6 S2 | P b c n | 13.1928; 9.9503; 17.1498 90; 90; 90 | 2251.29 | Legrand, Vincent; Pillet, Sébastien; Weber, Hans-Peter; Souhassou, Mohamed; Létard, Jean-François; Guionneau, Philippe; Lecomte, Claude On the precision and accuracy of structural analysis of light-induced metastable states Journal of Applied Crystallography, 2007, 40, 1076-1088 |
| 2300187 | CIF HKL | C26 H16 Fe N6 S2 | P b c n | 13.185; 9.948; 17.135 90; 90; 90 | 2247.5 | Legrand, Vincent; Pillet, Sébastien; Weber, Hans-Peter; Souhassou, Mohamed; Létard, Jean-François; Guionneau, Philippe; Lecomte, Claude On the precision and accuracy of structural analysis of light-induced metastable states Journal of Applied Crystallography, 2007, 40, 1076-1088 |
| 2300188 | CIF HKL | C26 H16 Fe N6 S2 | P b c n | 12.762; 10.024; 17.09 90; 90; 90 | 2186.3 | Legrand, Vincent; Pillet, Sébastien; Weber, Hans-Peter; Souhassou, Mohamed; Létard, Jean-François; Guionneau, Philippe; Lecomte, Claude On the precision and accuracy of structural analysis of light-induced metastable states Journal of Applied Crystallography, 2007, 40, 1076-1088 |
| 2300189 | CIF | Al2.34 Ca0.02 Fe0.02 H4 K0.78 Mg0.34 Na0.02 O12 On Si3.35 | C 1 2/m 1 | 5.189; 8.953; 10.129 90; 101.11; 90 | 461.796 | Gualtieri, Alessandro F.; Ferrari, Simone; Leoni, Matteo; Grathoff, Georg; Hugo, Richard; Shatnawi, Mouath; Paglia, Gianluca; Billinge, Simon Structural characterization of the clay mineral illite-1M Journal of Applied Crystallography, 2008, 41, 402-415 |
| 2300190 | CIF | Al2.34 Ca0.02 Fe0.02 H4 K0.78 Mg0.34 Na0.02 O12 On Si3.35 | C 1 2/m 1 | 5.197; 8.961; 10.159 90; 100.97; 90 | 464.5 | Gualtieri, Alessandro F.; Ferrari, Simone; Leoni, Matteo; Grathoff, Georg; Hugo, Richard; Shatnawi, Mouath; Paglia, Gianluca; Billinge, Simon Structural characterization of the clay mineral illite-1M Journal of Applied Crystallography, 2008, 41, 402-415 |
| 2300191 | CIF | Al2.34 Ca0.02 Fe0.02 H4 K0.78 Mg0.34 Na0.02 O12 On Si3.35 | C 1 2/m 1 | 5.1977; 9.014; 9.99 90; 100.95; 90 | 459.5 | Gualtieri, Alessandro F.; Ferrari, Simone; Leoni, Matteo; Grathoff, Georg; Hugo, Richard; Shatnawi, Mouath; Paglia, Gianluca; Billinge, Simon Structural characterization of the clay mineral illite-1M Journal of Applied Crystallography, 2008, 41, 402-415 |
| 2300192 | CIF | Al2.34 Ca0.02 Fe0.02 H4 K0.78 Mg0.34 Na0.02 O12 On Si3.35 | C 1 2/m 1 | 5.167; 8.983; 10.01 90; 100.5; 90 | 456.8 | Gualtieri, Alessandro F.; Ferrari, Simone; Leoni, Matteo; Grathoff, Georg; Hugo, Richard; Shatnawi, Mouath; Paglia, Gianluca; Billinge, Simon Structural characterization of the clay mineral illite-1M Journal of Applied Crystallography, 2008, 41, 402-415 |
| 2300193 | CIF Paper | C50 H64 O16 | I 1 2 1 | 21.1388; 9.1628; 24.5916 90; 98.1462; 90 | 4715.1 | Nishibori, Eiji; Ogura, Tadakatsu; Aoyagi, Shinobu; Sakata, Makoto <i>Ab initio</i> structure determination of a pharmaceutical compound, prednisolone succinate, from synchrotron powder data by combination of a genetic algorithm and the maximum entropy method Journal of Applied Crystallography, 2008, 41, 292-301 |
| 2300194 | CIF Paper | C50 H64 O16 | I 1 2 1 | 21.0262; 9.1138; 24.3796 90; 98.3396; 90 | 4622.43 | Nishibori, Eiji; Ogura, Tadakatsu; Aoyagi, Shinobu; Sakata, Makoto <i>Ab initio</i> structure determination of a pharmaceutical compound, prednisolone succinate, from synchrotron powder data by combination of a genetic algorithm and the maximum entropy method Journal of Applied Crystallography, 2008, 41, 292-301 |
| 2300195 | CIF Paper | C50 H64 O16 | I 1 2 1 | 20.9107; 9.0536; 24.2008 90; 98.9412; 90 | 4525.95 | Nishibori, Eiji; Ogura, Tadakatsu; Aoyagi, Shinobu; Sakata, Makoto <i>Ab initio</i> structure determination of a pharmaceutical compound, prednisolone succinate, from synchrotron powder data by combination of a genetic algorithm and the maximum entropy method Journal of Applied Crystallography, 2008, 41, 292-301 |
| 2300196 | CIF HKL Paper | Na O8 W2 Y0.95 Yb0.05 | I 41/a :2 | 5.2039; 5.2039; 11.2838 90; 90; 90 | 305.57 | Fan, Jiandong; Zhang, Huaijin; Yu, Wentao; Yu, Haohai; Wang, Jiyang; Jiang, Minhua A Yb^3+^-doped NaY(WO~4~)~2~ crystal grown by the Czochralski technique Journal of Applied Crystallography, 2008, 41, 584-591 |
| 2300197 | CIF HKL Paper | F7 K2 Ta | P n m a | 10.0731; 5.9456; 12.1527 90; 90; 90 | 727.83 | Smrčok, Ľubomír; Brunelli, Michela; Boča, Miroslav; Kucharík, Marian Structure of K~2~TaF~7~ at 993K: the combined use of synchrotron powder data and solid-state DFT calculations Journal of Applied Crystallography, 2008, 41, 634-636 |
| 2300198 | CIF Paper | ? | P -1 | 6.217; 6.985; 10.506 94.686; 100.568; 98.884 | 440.26 | Morgenroth, Wolfgang; Overgaard, Jacob; Clausen, Henrik F.; Svendsen, Helle; Jørgensen, Mads R. V.; Larsen, Finn K.; Iversen, Bo B. Helium cryostat synchrotron charge densities determined using a large CCD detector ‒ the upgraded beamline D3 at DESY Journal of Applied Crystallography, 2008, 41, 846-853 |
| 2300199 | CIF | Fe0.2 Mg0.8 O | F m -3 m | 4.19971; 4.19971; 4.19971 90; 90; 90 | 74.073 | Wood, Ian G.; Vočadlo, Lidunka; Dobson, David P.; Price, G. David; Fortes, A. D.; Cooper, Frances J.; Neale, J. W.; Walker, Andrew M.; Marshall, W. G.; Tucker, M. G.; Francis, D. J.; Stone, H. J.; McCammon, C. A. Thermoelastic properties of magnesiowüstite, (Mg~1{-~<i>x</i>}Fe~<i>x~</i>)O: determination of the Anderson‒Grüneisen parameter by time-of-flight neutron powder diffraction at simultaneous high pressures and temperatures Journal of Applied Crystallography, 2008, 41, 886-896 |
| 2300200 | CIF | Fe | I m -3 m | 2.8403; 2.84034; 2.84034 90; 90; 90 | 22.914 | Wood, Ian G.; Vočadlo, Lidunka; Dobson, David P.; Price, G. David; Fortes, A. D.; Cooper, Frances J.; Neale, J. W.; Walker, Andrew M.; Marshall, W. G.; Tucker, M. G.; Francis, D. J.; Stone, H. J.; McCammon, C. A. Thermoelastic properties of magnesiowüstite, (Mg~1{-~<i>x</i>}Fe~<i>x~</i>)O: determination of the Anderson‒Grüneisen parameter by time-of-flight neutron powder diffraction at simultaneous high pressures and temperatures Journal of Applied Crystallography, 2008, 41, 886-896 |
| 2300201 | CIF | Fe0.3 Mg0.7 O | F m -3 m | 4.1896; 4.18955; 4.18955 90; 90; 90 | 73.537 | Wood, Ian G.; Vočadlo, Lidunka; Dobson, David P.; Price, G. David; Fortes, A. D.; Cooper, Frances J.; Neale, J. W.; Walker, Andrew M.; Marshall, W. G.; Tucker, M. G.; Francis, D. J.; Stone, H. J.; McCammon, C. A. Thermoelastic properties of magnesiowüstite, (Mg~1{-~<i>x</i>}Fe~<i>x~</i>)O: determination of the Anderson‒Grüneisen parameter by time-of-flight neutron powder diffraction at simultaneous high pressures and temperatures Journal of Applied Crystallography, 2008, 41, 886-896 |
| 2300202 | CIF | Fe | I m -3 m | 2.8274; 2.8274; 2.8274 90; 90; 90 | 22.603 | Wood, Ian G.; Vočadlo, Lidunka; Dobson, David P.; Price, G. David; Fortes, A. D.; Cooper, Frances J.; Neale, J. W.; Walker, Andrew M.; Marshall, W. G.; Tucker, M. G.; Francis, D. J.; Stone, H. J.; McCammon, C. A. Thermoelastic properties of magnesiowüstite, (Mg~1{-~<i>x</i>}Fe~<i>x~</i>)O: determination of the Anderson‒Grüneisen parameter by time-of-flight neutron powder diffraction at simultaneous high pressures and temperatures Journal of Applied Crystallography, 2008, 41, 886-896 |
| 2300203 | CIF | O2 Zr | P 1 21/c 1 | 5.213; 4.967; 5.318 90; 100.16; 90 | 135.5 | Wood, Ian G.; Vočadlo, Lidunka; Dobson, David P.; Price, G. David; Fortes, A. D.; Cooper, Frances J.; Neale, J. W.; Walker, Andrew M.; Marshall, W. G.; Tucker, M. G.; Francis, D. J.; Stone, H. J.; McCammon, C. A. Thermoelastic properties of magnesiowüstite, (Mg~1{-~<i>x</i>}Fe~<i>x~</i>)O: determination of the Anderson‒Grüneisen parameter by time-of-flight neutron powder diffraction at simultaneous high pressures and temperatures Journal of Applied Crystallography, 2008, 41, 886-896 |
| 2300204 | CIF Paper | C7 H6 Cl N3 O4 S2 | P 1 | 4.8481; 6.359; 8.9 74.49; 83.9; 80.53 | 260.22 | Fernandes, P.; Shankland, K.; David, W. I. F.; Markvardsen, A. J.; Florence, A. J.; Shankland, N.; Leech, C. K. A differential thermal expansion approach to crystal structure determination from powder diffraction data Journal of Applied Crystallography, 2008, 41, 1089-1094 |
| 2300205 | CIF Paper | C7 H6 Cl N3 O4 S2 | P 1 | 4.8619; 6.377; 8.926 74.4; 83.93; 80.56 | 262.39 | Fernandes, P.; Shankland, K.; David, W. I. F.; Markvardsen, A. J.; Florence, A. J.; Shankland, N.; Leech, C. K. A differential thermal expansion approach to crystal structure determination from powder diffraction data Journal of Applied Crystallography, 2008, 41, 1089-1094 |
| 2300206 | CIF Paper | C7 H6 Cl N3 O4 S2 | P 1 | 4.8707; 6.3951; 8.9448 74.368; 83.786; 80.459 | 264.01 | Fernandes, P.; Shankland, K.; David, W. I. F.; Markvardsen, A. J.; Florence, A. J.; Shankland, N.; Leech, C. K. A differential thermal expansion approach to crystal structure determination from powder diffraction data Journal of Applied Crystallography, 2008, 41, 1089-1094 |
| 2300207 | CIF Paper | C7 H6 Cl N3 O4 S2 | P 1 | 4.8737; 6.4046; 8.9548 74.324; 83.751; 80.449 | 264.79 | Fernandes, P.; Shankland, K.; David, W. I. F.; Markvardsen, A. J.; Florence, A. J.; Shankland, N.; Leech, C. K. A differential thermal expansion approach to crystal structure determination from powder diffraction data Journal of Applied Crystallography, 2008, 41, 1089-1094 |
| 2300208 | CIF Paper | C7 H6 Cl N3 O4 S2 | P 1 | 4.8786; 6.4126; 8.9665 74.266; 83.693; 80.445 | 265.63 | Fernandes, P.; Shankland, K.; David, W. I. F.; Markvardsen, A. J.; Florence, A. J.; Shankland, N.; Leech, C. K. A differential thermal expansion approach to crystal structure determination from powder diffraction data Journal of Applied Crystallography, 2008, 41, 1089-1094 |
| 2300209 | CIF Paper | C46 H42 Fe O12 | P 1 21 1 | 5.857; 24.105; 14.069 90; 93.15; 90 | 1983.3 | Okabe, Takashi; Nakazaki, Keisuke; Igaue, Tsuyoshi; Nakamura, Naotake; Donnio, Bertrand; Guillon, Daniel; Gallani, Jean-Louis Synthesis and physical properties of ferrocene derivatives. XXI. Crystal structure of a liquid crystalline ferrocene derivative, 1,1'-bis[3-[4-(4-methoxyphenoxycarbonyl)phenoxy]propyloxycarbonyl]ferrocene Journal of Applied Crystallography, 2009, 42, 63-68 |
| 2300210 | CIF HKL Paper | C2 H2 Ca O5 | P 1 21/c 1 | 6.316; 14.541; 10.116 90; 109; 90 | 878.4 | Daudon, Michel; Bazin, Dominique; André, Gilles; Jungers, Paul; Cousson, Alain; Chevallier, Pierre; Véron, Emmanuel; Matzen, Guy Examination of whewellite kidney stones by scanning electron microscopy and powder neutron diffraction techniques Journal of Applied Crystallography, 2009, 42, 109-115 |
| 2300211 | CIF Paper | Lu2 O5 Si | I 1 2/a 1 | 10.255; 6.6465; 12.3626 90; 102.422; 90 | 822.91 | Cong, Hengjiang; Zhang, Huaijin; Wang, Jiyang; Yu, Wentao; Fan, Jiandong; Cheng, Xiufeng; Sun, Shangqian; Zhang, Jian; Lu, Qingming; Jiang, Chunjian; Boughton, Robert I. Structural and thermal properties of the monoclinic Lu~2~SiO~5~ single crystal: evaluation as a new laser matrix Journal of Applied Crystallography, 2009, 42, 284-294 |
| 2300212 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6696; 7.889; 10.7287 90; 99.427; 90 | 1224.85 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300213 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6712; 7.8893; 10.7288 90; 99.428; 90 | 1225.05 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300214 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6662; 7.8879; 10.7275 90; 99.432; 90 | 1224.23 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300215 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6689; 7.8884; 10.728 90; 99.429; 90 | 1224.61 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300216 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6682; 7.8889; 10.7276 90; 99.437; 90 | 1224.55 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300217 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6636; 7.8871; 10.7244 90; 99.417; 90 | 1223.6 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300218 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6703; 7.889; 10.7282 90; 99.429; 90 | 1224.84 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300219 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6698; 7.8878; 10.7265 90; 99.432; 90 | 1224.41 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300220 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.499; 7.7576; 10.6203 90; 99.741; 90 | 1177.3 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300221 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6706; 7.8885; 10.7284 90; 99.426; 90 | 1224.81 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300222 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.6655; 7.8817; 10.724 90; 99.427; 90 | 1222.8 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300223 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.494; 7.7528; 10.6655 90; 99.875; 90 | 1180.7 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300224 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.673; 7.8892; 10.7316 90; 99.436; 90 | 1225.45 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300225 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.669; 7.8804; 10.7272 90; 99.439; 90 | 1223.3 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300226 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.528; 7.7695; 10.691 90; 99.89; 90 | 1188.8 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300227 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.67; 7.8886; 10.7304 90; 99.43; 90 | 1225 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300228 | CIF Paper | C13 H18 O2 | P 1 21/c 1 | 14.683; 7.86; 10.729 90; 99.456; 90 | 1221.4 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300229 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.88606; 9.38115; 7.10099 90; 115.701; 90 | 773.484 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300230 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.88559; 9.38013; 7.10096 90; 115.7; 90 | 773.38 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300231 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.8865; 9.3822; 7.10147 90; 115.702; 90 | 773.65 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300232 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.89; 9.38466; 7.10325 90; 115.702; 90 | 774.26 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300233 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.8863; 9.38162; 7.10158 90; 115.701; 90 | 773.61 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300234 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.8871; 9.3824; 7.1018 90; 115.703; 90 | 773.73 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300235 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.8905; 9.38488; 7.10342 90; 115.701; 90 | 774.32 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300236 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.887; 9.3819; 7.1015 90; 115.701; 90 | 773.66 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300237 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.8858; 9.3812; 7.1013 90; 115.703; 90 | 773.5 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300238 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.889; 9.38347; 7.10271 90; 115.702; 90 | 774.04 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300239 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.8856; 9.3812; 7.10114 90; 115.697; 90 | 773.5 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300240 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.8844; 9.3824; 7.1025 90; 115.709; 90 | 773.6 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300241 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.8887; 9.384; 7.1025 90; 115.702; 90 | 774.05 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300242 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.8869; 9.3833; 7.1022 90; 115.706; 90 | 773.82 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300243 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.656; 9.564; 7.236 90; 117.1; 90 | 779.7 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300244 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.885; 9.3862; 7.1008 90; 115.714; 90 | 773.8 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300245 | CIF Paper | C8 H9 N O2 | P 1 21/a 1 | 12.864; 9.354; 7.104 90; 115.83; 90 | 769.4 | Stone, Kevin H.; Lapidus, Saul H.; Stephens, Peter W. Implementation and use of robust refinement in powder diffraction in the presence of impurities Journal of Applied Crystallography, 2009, 42, 385-391 |
| 2300246 | CIF | Co Li O4 P | P n m a | 10.202; 5.918; 4.709 90; 90; 90 | 284.3 | Kimura, Tsunehisa; Chang, Chengkang; Kimura, Fumiko; Maeyama, Masataka The pseudo-single-crystal method: a third approach to crystal structure determination Journal of Applied Crystallography, 2009, 42, 535-537 |
| 2300247 | CIF | D | P 1 21/n 1 | 7.78366; 6.72568; 6.07443 90; 102.104; 90 | 310.929 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300248 | CIF | D | P b c a | 18.8679; 6.94772; 6.85885 90; 90; 90 | 899.12 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300249 | CIF | D2 O | R -3 :H | 12.87078; 12.87078; 6.1827 90; 90; 120 | 886.99 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300250 | CIF | Al | F m -3 m | 4.03702; 4.03702; 4.03702 90; 90; 90 | 65.793 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300251 | CIF | D2 O | P 41 21 2 | 6.6748; 6.67484; 6.6838 90; 90; 90 | 297.78 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300252 | CIF | C W | P -6 m 2 | 2.9016; 2.90156; 2.83867 90; 90; 120 | 20.697 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300253 | CIF | D | P n c n | 12.5626; 6.6513; 6.3788 90; 90; 90 | 533 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300254 | CIF | D2 O | R -3 :H | 12.8396; 12.8396; 6.1628 90; 90; 120 | 879.86 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300255 | CIF | D10 O5 | P 42/n m c :2 | 6.186; 6.186; 5.7157 90; 90; 90 | 218.72 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300256 | CIF | Pb | F m -3 m | 4.9108; 4.91075; 4.91075 90; 90; 90 | 118.426 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300257 | CIF | D | I -4 2 d | 8.15; 8.15; 4 90; 90; 90 | 265.69 | Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F. Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa Journal of Applied Crystallography, 2009, 42, 846-866 |
| 2300258 | CIF | Ca H4 O6 S | C 1 2/c 1 | 6.28689; 15.2131; 6.52996 90; 127.43; 90 | 495.95 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Neutron powder diffraction in materials with incoherent scattering: an illustration of Rietveld refinement quality from nondeuterated gypsum Journal of Applied Crystallography, 2009, 42, 1176-1188 |
| 2300259 | CIF | Ca H4 O6 S | I 1 2/c 1 | 5.68021; 15.2139; 6.53032 90; 118.484; 90 | 496.03 | Henry, Paul F.; Weller, Mark T.; Wilson, Chick C. Neutron powder diffraction in materials with incoherent scattering: an illustration of Rietveld refinement quality from nondeuterated gypsum Journal of Applied Crystallography, 2009, 42, 1176-1188 |
| 2300260 | CIF | C D7 N O | P b c a | 11.0232; 7.66076; 7.59127 90; 90; 90 | 641.053 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol monoammoniate (CD~3~OD·ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2009, 42, 1054-1061 |
| 2300261 | CIF | C D7 N O | P b c a | 11.21169; 7.74663; 7.68077 90; 90; 90 | 667.096 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol monoammoniate (CD~3~OD·ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2009, 42, 1054-1061 |
| 2300262 | CIF HKL Paper | C17 H30 F N3 O9 | P -1 | 9.507; 9.9649; 11.0233 94.182; 100.118; 91.432 | 1024.57 | Dittrich, B.; Hübschle, C. B.; Holstein, J. J.; Fabbiani, F. P. A. Towards extracting the charge density from normal-resolution data Journal of Applied Crystallography, 2009, 42, 1110-1121 |
| 2300263 | CIF Paper | C17 H21.8 Cl F N3 O4.4 | P 1 21/c 1 | 12.872; 19.576; 6.948 90; 90.55; 90 | 1750.7 | Dittrich, B.; Hübschle, C. B.; Holstein, J. J.; Fabbiani, F. P. A. Towards extracting the charge density from normal-resolution data Journal of Applied Crystallography, 2009, 42, 1110-1121 |
| 2300264 | CIF | C12 H22 O11 | P 1 21 1 | 7.7735; 8.7169; 10.8765 90; 102.936; 90 | 718.3 | Kimura, Fumiko; Kimura, Tsunehisa; Oshima, Wataru; Maeyama, Masataka; Aburaya, Kazuaki X-ray diffraction study of a pseudo single crystal prepared from a crystal belonging to point group 2 Journal of Applied Crystallography, 2010, 43, 151-153 |
| 2300265 | CIF Paper | C15 H14 Br N5 O2 | P -1 | 11.479; 14.738; 4.476 93.65; 94.16; 93.71 | 751.9 | Lasocha, W.; Gaweł, B.; Rafalska-Lasocha, A.; Pawłowski, M.; Talik, P.; Paszkowicz, W. Crystal structure study of selected xanthine derivatives Journal of Applied Crystallography, 2010, 43, 163-167 |
| 2300266 | CIF | C D7 N O | P b c a | 11.0386; 7.65471; 7.58467 90; 90; 90 | 640.88 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol hemiammoniate (CD~3~OD·0.5ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2010, 43, 328-336 |
| 2300267 | CIF | C2 D11 N O2 | P n 21 a | 12.70615; 8.84589; 4.73876 90; 90; 90 | 532.623 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol hemiammoniate (CD~3~OD·0.5ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2010, 43, 328-336 |
| 2300268 | CIF | C D7 N O | P b c a | 11.20962; 7.74564; 7.6781 90; 90; 90 | 666.66 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol hemiammoniate (CD~3~OD·0.5ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2010, 43, 328-336 |
| 2300269 | CIF | C2 D11 N O2 | P n 21 a | 12.90413; 8.96975; 4.79198 90; 90; 90 | 554.656 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol hemiammoniate (CD~3~OD·0.5ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2010, 43, 328-336 |
| 2300270 | CIF | C10 H13 N O3 | P 1 21/n 1 | 13.00247; 6.86966; 11.51889 90; 108.329; 90 | 976.695 | Pagola, Silvina; Stephens, Peter W. <i>PSSP</i>, a computer program for the crystal structure solution of molecular materials from X-ray powder diffraction data Journal of Applied Crystallography, 2010, 43, 370-376 |
| 2300271 | CIF | C8 H10 O2 | P 1 21/n 1 | 9.8417; 15.4813; 4.8422 90; 101.258; 90 | 723.57 | Pagola, Silvina; Stephens, Peter W. <i>PSSP</i>, a computer program for the crystal structure solution of molecular materials from X-ray powder diffraction data Journal of Applied Crystallography, 2010, 43, 370-376 |
| 2300272 | CIF | C2 H4 N4 S | P 1 21/a 1 | 9.849; 12.3828; 3.99952 90; 102.126; 90 | 476.891 | Pagola, Silvina; Stephens, Peter W. <i>PSSP</i>, a computer program for the crystal structure solution of molecular materials from X-ray powder diffraction data Journal of Applied Crystallography, 2010, 43, 370-376 |
| 2300273 | CIF Paper | Ca5 H O13 P3 | P 63/m | 9.421; 9.421; 6.88 90; 90; 120 | 528.826 | Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing Journal of Applied Crystallography, 2010, 43, 320-327 |
| 2300274 | CIF Paper | ? | P 63/m | 9.417; 9.417; 6.867 90; 90; 120 | 527.38 | Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing Journal of Applied Crystallography, 2010, 43, 320-327 |
| 2300275 | CIF Paper | ? | P 63/m | 9.4039; 9.4039; 6.8526 90; 90; 120 | 524.81 | Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing Journal of Applied Crystallography, 2010, 43, 320-327 |
| 2300276 | CIF Paper | ? | P 63/m | 9.4109; 9.4109; 6.8456 90; 90; 120 | 525.05 | Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing Journal of Applied Crystallography, 2010, 43, 320-327 |
| 2300277 | CIF Paper | ? | P 63/m | 9.4072; 9.4072; 6.84 90; 90; 120 | 524.21 | Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing Journal of Applied Crystallography, 2010, 43, 320-327 |
| 2300278 | CIF Paper | La O4 V | P 1 21/n 1 | 7.0492; 7.2827; 6.725 90; 104.901; 90 | 333.63 | Cong, Hengjiang; Zhang, Huaijin; Sun, Shangqian; Yu, Yonggui; Yu, Wentao; Yu, Haohai; Zhang, Jian; Wang, Jiyang; Boughton, Robert I. Morphological study of Czochralski-grown lanthanide orthovanadate single crystals and implications on the mechanism of bulk spiral formation Journal of Applied Crystallography, 2010, 43, 308-319 |
| 2300279 | CIF | Co0.15 Cr0.42 Mn0.19 O | F d -3 m :2 | 8.3777; 8.3777; 8.3777 90; 90; 90 | 588 | Purwanto, A.; Fajar, A.; Mugirahardjo, H.; Fergus, J. W.; Wang, K. Cation distribution in spinel (Mn,Co,Cr)~3~O~4~ at room temperature Journal of Applied Crystallography, 2010, 43, 394-400 |
| 2300280 | CIF | Co0.43 Mn0.32 O | F d -3 m :2 | 8.2685; 8.2685; 8.2685 90; 90; 90 | 565.3 | Purwanto, A.; Fajar, A.; Mugirahardjo, H.; Fergus, J. W.; Wang, K. Cation distribution in spinel (Mn,Co,Cr)~3~O~4~ at room temperature Journal of Applied Crystallography, 2010, 43, 394-400 |
| 2300281 | CIF | Co0.23 Mn0.52 O | I 41/a m d :2 | 5.7184; 5.7184; 9.2079 90; 90; 90 | 301.1 | Purwanto, A.; Fajar, A.; Mugirahardjo, H.; Fergus, J. W.; Wang, K. Cation distribution in spinel (Mn,Co,Cr)~3~O~4~ at room temperature Journal of Applied Crystallography, 2010, 43, 394-400 |
| 2300282 | CIF | Co0.33 Mn0.42 O | F d -3 m :2 | 8.3015; 8.3015; 8.3015 90; 90; 90 | 572.1 | Purwanto, A.; Fajar, A.; Mugirahardjo, H.; Fergus, J. W.; Wang, K. Cation distribution in spinel (Mn,Co,Cr)~3~O~4~ at room temperature Journal of Applied Crystallography, 2010, 43, 394-400 |
| 2300283 | CIF Paper | F2 O Ti | R -3 c :H | 5.3325; 5.3325; 13.2321 90; 90; 120 | 325.853 | Shian, Samuel; Sandhage, Kenneth H. Hexagonal and cubic TiOF~2~ Journal of Applied Crystallography, 2010, 43, 757-761 |
| 2300284 | CIF Paper | Ni0.9 O Zn0.1 | F m -3 m | 4.18564; 4.18564; 4.18564 90; 90; 90 | 73.3307 | Kremenović, Aleksandar; Antić, Bratislav; Vučinić-Vasić, Milica; Colomban, Philippe; Jovalekić, Čedomir; Bibić, Nataša; Kahlenberg, Volker; Leoni, Matteo Temperature-induced structure and microstructure evolution of nanostructured Ni~0.9~Zn~0.1~O Journal of Applied Crystallography, 2010, 43, 699-709 |
| 2300285 | CIF Paper | Ni0.9 O Zn0.1 | F m -3 m | 4.18419; 4.18419; 4.18419 90; 90; 90 | 73.2545 | Kremenović, Aleksandar; Antić, Bratislav; Vučinić-Vasić, Milica; Colomban, Philippe; Jovalekić, Čedomir; Bibić, Nataša; Kahlenberg, Volker; Leoni, Matteo Temperature-induced structure and microstructure evolution of nanostructured Ni~0.9~Zn~0.1~O Journal of Applied Crystallography, 2010, 43, 699-709 |
| 2300286 | CIF Paper | Ni0.9 O Zn0.1 | F m -3 m | 4.18455; 4.18455; 4.18455 90; 90; 90 | 73.2734 | Kremenović, Aleksandar; Antić, Bratislav; Vučinić-Vasić, Milica; Colomban, Philippe; Jovalekić, Čedomir; Bibić, Nataša; Kahlenberg, Volker; Leoni, Matteo Temperature-induced structure and microstructure evolution of nanostructured Ni~0.9~Zn~0.1~O Journal of Applied Crystallography, 2010, 43, 699-709 |
| 2300287 | CIF Paper | Ni0.9 O Zn0.1 | F m -3 m | 4.188219; 4.188219; 4.188219 90; 90; 90 | 73.4663 | Kremenović, Aleksandar; Antić, Bratislav; Vučinić-Vasić, Milica; Colomban, Philippe; Jovalekić, Čedomir; Bibić, Nataša; Kahlenberg, Volker; Leoni, Matteo Temperature-induced structure and microstructure evolution of nanostructured Ni~0.9~Zn~0.1~O Journal of Applied Crystallography, 2010, 43, 699-709 |
| 2300288 | CIF Paper | Ni0.9 O Zn0.1 | F m -3 m | 4.188195; 4.188195; 4.188195 90; 90; 90 | 73.465 | Kremenović, Aleksandar; Antić, Bratislav; Vučinić-Vasić, Milica; Colomban, Philippe; Jovalekić, Čedomir; Bibić, Nataša; Kahlenberg, Volker; Leoni, Matteo Temperature-induced structure and microstructure evolution of nanostructured Ni~0.9~Zn~0.1~O Journal of Applied Crystallography, 2010, 43, 699-709 |
| 2300289 | CIF Paper | Fe2 Ni O4 | F d -3 m :2 | 8.35966; 8.35966; 8.35966 90; 90; 90 | 584.206 | Kremenović, Aleksandar; Antić, Bratislav; Vučinić-Vasić, Milica; Colomban, Philippe; Jovalekić, Čedomir; Bibić, Nataša; Kahlenberg, Volker; Leoni, Matteo Temperature-induced structure and microstructure evolution of nanostructured Ni~0.9~Zn~0.1~O Journal of Applied Crystallography, 2010, 43, 699-709 |
| 2300290 | CIF Paper | Ni0.9 O Zn0.1 | R -3 m :H | 2.95403; 2.95403; 7.2801 90; 90; 120 | 55.017 | Kremenović, Aleksandar; Antić, Bratislav; Vučinić-Vasić, Milica; Colomban, Philippe; Jovalekić, Čedomir; Bibić, Nataša; Kahlenberg, Volker; Leoni, Matteo Temperature-induced structure and microstructure evolution of nanostructured Ni~0.9~Zn~0.1~O Journal of Applied Crystallography, 2010, 43, 699-709 |
| 2300291 | CIF Paper | Ni0.9 O Zn0.1 | R -3 m :H | 2.95557; 2.95557; 7.2626 90; 90; 120 | 54.942 | Kremenović, Aleksandar; Antić, Bratislav; Vučinić-Vasić, Milica; Colomban, Philippe; Jovalekić, Čedomir; Bibić, Nataša; Kahlenberg, Volker; Leoni, Matteo Temperature-induced structure and microstructure evolution of nanostructured Ni~0.9~Zn~0.1~O Journal of Applied Crystallography, 2010, 43, 699-709 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!