Crystallography Open Database
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Result : There are 19 entries in the selection
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Searching journal of publication like 'Journal of Applied Crystallography' volume of publication is 46
| COD ID: 2300375 | |
| CIF file | Formula: - Al2 O3 - Comments: Wood, Ian G.; Ahmed, Jabraan; Dobson, David P.; Vočadlo, Lidunka High-pressure phase transitions and equations of state in NiSi. III. A new high-pressure phase of NiSi Journal of Applied Crystallography 46(1) (2013) 14-24 Space group: R -3 c :H Cell volume: 254.96 Cell parameters: 4.76029; 4.76029; 12.992; 90; 90; 120; |
| COD ID: 2300376 | |
| CIF file | Formula: - Ni Si - Comments: Wood, Ian G.; Ahmed, Jabraan; Dobson, David P.; Vočadlo, Lidunka High-pressure phase transitions and equations of state in NiSi. III. A new high-pressure phase of NiSi Journal of Applied Crystallography 46(1) (2013) 14-24 Space group: P 21 3 Cell volume: 90.9295 Cell parameters: 4.49678; 4.49678; 4.49678; 90; 90; 90; |
| COD ID: 2300377 | |
| CIF file | Formula: - Ni Si - Comments: Wood, Ian G.; Ahmed, Jabraan; Dobson, David P.; Vočadlo, Lidunka High-pressure phase transitions and equations of state in NiSi. III. A new high-pressure phase of NiSi Journal of Applied Crystallography 46(1) (2013) 14-24 Space group: P m m n :2 Cell volume: 46.544 Cell parameters: 3.2735; 3.02662; 4.69776; 90; 90; 90; |
| COD ID: 2300380 | |
| CIF file | Formula: - C15 H4 Cu2 O10 - Comments: Yakovenko, Andrey A.; Reibenspies, Joseph H.; Bhuvanesh, Nattamai; Zhou, Hong-Cai Generation and applications of structure envelopes for porous metal‒organic frameworks Journal of Applied Crystallography 46(2) (2013) 346-353 Space group: F m -3 m Cell volume: 18198.5 Cell parameters: 26.3034; 26.3034; 26.3034; 90; 90; 90; |
| COD ID: 2300381 | |
| CIF file | Formula: - C33 H4 Cu2 O10 - Comments: Yakovenko, Andrey A.; Reibenspies, Joseph H.; Bhuvanesh, Nattamai; Zhou, Hong-Cai Generation and applications of structure envelopes for porous metal‒organic frameworks Journal of Applied Crystallography 46(2) (2013) 346-353 Space group: F m -3 m Cell volume: 18226.1 Cell parameters: 26.3167; 26.3167; 26.3167; 90; 90; 90; |
| COD ID: 2300382 | |
| CIF file | Formula: - C8.5 H7 Cu N5 O2 - Comments: Yakovenko, Andrey A.; Reibenspies, Joseph H.; Bhuvanesh, Nattamai; Zhou, Hong-Cai Generation and applications of structure envelopes for porous metal‒organic frameworks Journal of Applied Crystallography 46(2) (2013) 346-353 Space group: C 1 2/c 1 Cell volume: 2225.8 Cell parameters: 28.697; 9.2637; 9.3223; 90; 116.087; 90; |
| COD ID: 2300383 | |
| CIF file | Formula: - C356 H32 Y4 - Comments: Maki, Sachiko; Nishibori, Eiji; Kawaguchi, Daisuke; Sakata, Makoto; Takata, Masaki; Inoue, Takashi; Shinohara, Hisanori Element-selective charge density visualization of endohedral metallofullerenes using synchrotron X-ray multi-wavelength anomalous powder diffraction data Journal of Applied Crystallography 46(3) (2013) 649-655 Space group: C m c 21 Cell volume: 4386.13 Cell parameters: 11.22205; 34.8174; 11.22569; 90; 90; 90; |
| COD ID: 2300384 | |
| CIF file | Formula: - C13 H10 O - Comments: Reilly, Anthony M.; Wann, Derek A.; Gutmann, Matthias J.; Jura, Marek; Morrison, Carole A.; Rankin, David W. H. Predicting anisotropic displacement parameters using molecular dynamics: density functional theory plus dispersion modelling of thermal motion in benzophenone Journal of Applied Crystallography 46(3) (2013) 656-662 Space group: P 21 21 21 Cell volume: 992.2 Cell parameters: 7.979; 10.274; 12.103; 90; 90; 90; |
| COD ID: 2300385 | |
| CIF file | Formula: - C13 H10 O - Comments: Reilly, Anthony M.; Wann, Derek A.; Gutmann, Matthias J.; Jura, Marek; Morrison, Carole A.; Rankin, David W. H. Predicting anisotropic displacement parameters using molecular dynamics: density functional theory plus dispersion modelling of thermal motion in benzophenone Journal of Applied Crystallography 46(3) (2013) 656-662 Space group: P 21 21 21 Cell volume: 949.2 Cell parameters: 7.7145; 10.2301; 12.0269; 90; 90; 90; |
| COD ID: 2300386 | |
| CIF file | Formula: - C13 H10 O - Comments: Reilly, Anthony M.; Wann, Derek A.; Gutmann, Matthias J.; Jura, Marek; Morrison, Carole A.; Rankin, David W. H. Predicting anisotropic displacement parameters using molecular dynamics: density functional theory plus dispersion modelling of thermal motion in benzophenone Journal of Applied Crystallography 46(3) (2013) 656-662 Space group: P 21 21 21 Cell volume: 1001.7 Cell parameters: 7.9958; 10.2907; 12.174; 90; 90; 90; |
| COD ID: 2300387 | |
| CIF file | Formula: - B3 Ba5 F O9 - Comments: Rashchenko, Sergey V.; Bekker, Tatyana B.; Bakakin, Vladimir V.; Seryotkin, Yurii V.; Kokh, Alexander E.; Gille, Peter; Popov, Arthur I.; Fedorov, Pavel P. A new mechanism of anionic substitution in fluoride borates Journal of Applied Crystallography 46(4) (2013) 1081-1084 Space group: P n m a Cell volume: 1160.57 Cell parameters: 7.60788; 14.8299; 10.2865; 90; 90; 90; |
| COD ID: 2300388 | |
| CIF file | Formula: - As0.84 Cu1.08 Mn0.94 - Comments: Wadley, P.; Crespi, A.; Gázquez, J.; Roldán, M.A.; García, P.; Novak, V.; Campion, R.; Jungwirth, T.; Rinaldi, C.; Martí, X.; Holy, V.; Frontera, C.; Rius, J. Obtaining the structure factors for an epitaxial film using Cu X-ray radiation Journal of Applied Crystallography 46(6) (2013) 1749-1754 Space group: P 4/n m m :2 Cell volume: 92.2 Cell parameters: 3.82; 3.82; 6.318; 90; 90; 90; |
| COD ID: 2300457 | |
| CIF file | Formula: - Ba0.41 Mo O4 Sr0.59 - Comments: Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E. Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals Journal of Applied Crystallography 46(5) (2013) 1434-1446 Space group: I 41/a :2 Cell volume: 378.488 Cell parameters: 5.50729; 5.50729; 12.4789; 90; 90; 90; |
| COD ID: 2300458 | |
| CIF file | Formula: - Ba0.73 Mo O4 Sr0.27 - Comments: Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E. Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals Journal of Applied Crystallography 46(5) (2013) 1434-1446 Space group: I 41/a :2 Cell volume: 390.075 Cell parameters: 5.54906; 5.54906; 12.66803; 90; 90; 90; |
| COD ID: 2300459 | |
| CIF file | Formula: - Ba Mo O4 - Comments: Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E. Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals Journal of Applied Crystallography 46(5) (2013) 1434-1446 Space group: I 41/a :2 Cell volume: 400.147 Cell parameters: 5.584828; 5.584828; 12.82922; 90; 90; 90; |
| COD ID: 2300460 | |
| CIF file | Formula: - Mo O4 Sr - Comments: Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E. Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals Journal of Applied Crystallography 46(5) (2013) 1434-1446 Space group: I 41/a :2 Cell volume: 351.463 Cell parameters: 5.402647; 5.402647; 12.04112; 90; 90; 90; |
| COD ID: 2300461 | |
| CIF file | Formula: - Ba0.19 Mo O4 Sr0.81 - Comments: Nogueira, I. C.; Cavalcante, L. S.; Pereira, P. F. S.; de Jesus, M. M.; Rivas Mercury, J. M.; Batista, N. C.; Li, M. Siu; Longo, E. Rietveld refinement, morphology and optical properties of (Ba~1{-~<i>x</i>}Sr<i>~x~</i>)MoO~4~ crystals Journal of Applied Crystallography 46(5) (2013) 1434-1446 Space group: I 41/a :2 Cell volume: 364.947 Cell parameters: 5.45711; 5.45711; 12.25476; 90; 90; 90; |
| COD ID: 2300500 | |
| CIF file | Formula: - C10 H16 N6 S - Comments: Arakcheeva, Alla; Pattison, Philip; Bauer-Brandl, Annette; Birkedal, Henrik; Chapuis, Gervais Cimetidine, C~10~H~16~N~6~S, form C: crystal structure and modelling of polytypes using the superspace approach Journal of Applied Crystallography 46(1) (2013) 99-107 Space group: C 1 2/c 1 Cell volume: 7263 Cell parameters: 82.904; 4.85; 18.76; 90; 74.34; 90; |
| COD ID: 2300547 | |
| CIF file | Formula: - C10 H16 N6 S - Comments: Arakcheeva, Alla; Pattison, Philip; Bauer-Brandl, Annette; Birkedal, Henrik; Chapuis, Gervais Cimetidine, C10H16N6S, form C: crystal structure and modelling of polytypes using the superspace approach Journal of Applied Crystallography 46(1) (2013) 99 Space group: P 1 2/c 1 (a,2*b,c) Cell volume: 1210.5 Cell parameters: 13.817; 4.85; 18.76; 90; 74.34; 90; |
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