Crystallography Open Database
Search results
Result: there are 68 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 space group like 'P 21/b 1 1'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1544376 | CIF | Al H3 O3 | P 21/b 1 1 | 8.612; 5.013; 9.194 90; 90; 90 | 396.9 | Komatsu, K.; Kuribayashi, T.; Kudoh, Y.; Kagi, H. Crystal structures of high-pressure phases in the alumina-water system: I. single crystal X-ray diffraction and molecular dynamics simulation of eta-Al(OH)3 : sample at 3.0 GPa, RT Z. Kristallogr., 2007, 222, 1-12 |
| 1545111 | CIF | Ba | P 21/b 1 1 | 11.608; 11.634; 4.634 90; 90; 90 | 625.81 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
| 1545112 | CIF | Ba | P 21/b 1 1 | 11.6146; 11.6256; 4.6341 90; 90; 90 | 625.727 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
| 1545113 | CIF | Ba | P 21/b 1 1 | 11.5313; 11.6527; 4.6109 90; 90; 90 | 619.57 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
| 1545114 | CIF | Ba | P 21/b 1 1 | 11.5457; 11.5882; 4.599 90; 90; 90 | 615.318 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
| 1545115 | CIF | Ba | P 21/b 1 1 | 11.4996; 11.5527; 4.6035 90; 90; 90 | 611.582 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
| 1545116 | CIF | Ba | P 21/b 1 1 | 11.439; 11.53; 4.5937 90; 90; 90 | 605.9 | Arakcheeva, Alla; Bykov, Maxim; Bykova, Elena; Dubrovinsky, Leonid; Pattison, Phil; Dmitriev, Vladimir; Chapuis, Gervais Incommensurate atomic density waves in the high-pressure IVb phase of barium IUCrJ, 2017, 4, 152-157 |
| 9010292 | CIF | C K O3 | P 21/b 1 1 | 10.024; 6.912; 4.1868 115.92; 90; 90 | 260.905 | Komatsu, K.; Kagi, H.; Nagai, T.; Kuribayashi, T.; Parise, J. B.; Kudoh, Y. Single-crystal X-ray diffraction study of high-pressure phases of KHCO3 Sample: phase IV, P = 4.6 GPa Note: high-pressure polymorph of kalcinite American Mineralogist, 2007, 92, 1270-1275 |
| 7211348 | CIF | C11 H0 O2 S4 | P 21/b 1 1 | 3.848; 11.006; 26.045 99.47; 90; 90 | 1088 | Simao, Claudia; Mas-Torrent, Marta; André, Vânia; Teresa Duarte, M.; Techert, Simone; Veciana, Jaume; Rovira, Concepció Solid state photodimerisation of tetrathiafulvalene derivatives bearing carboxylate and carboxylic acid substituents CrystEngComm, 2013, 15, 9878 |
| 4314582 | CIF | C2 H7 Mg O8 P | P 21/b 1 1 | 8.80982; 9.85013; 16.79792 93.3399; 90; 90 | 1455.21 | Rosario M. P. Colodrero; Pascual Olivera-Pastor; Aurelio Cabeza; Maria Papadaki; Konstantinos D. Demadis; Miguel A. G. Aranda Structural Mapping and Framework Interconversions in 1D, 2D, and 3D Divalent Metal R,S-Hydroxyphosphonoacetate Hybrids Inorganic Chemistry, 2010, 49, 761-768 |
| 4510308 | CIF | C4 H9 N O2 | P 21/b 1 1 | 11.1927; 9.9481; 18.6989 90.406; 90; 90 | 2082 | Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V. One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine Crystal Growth & Design, 2014, 14, 1851 |
| 4510309 | CIF | C4 H9 N O2 | P 21/b 1 1 | 11.1828; 9.9261; 18.6889 90.679; 90; 90 | 2074.35 | Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V. One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine Crystal Growth & Design, 2014, 14, 1851 |
| 4510310 | CIF | C4 H9 N O2 | P 21/b 1 1 | 11.1763; 9.915; 18.6822 90.912; 90; 90 | 2069.97 | Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V. One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine Crystal Growth & Design, 2014, 14, 1851 |
| 4510311 | CIF | C4 H9 N O2 | P 21/b 1 1 | 11.1668; 9.8988; 18.6714 91.313; 90; 90 | 2063.36 | Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V. One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine Crystal Growth & Design, 2014, 14, 1851 |
| 4510312 | CIF | C4 H9 N O2 | P 21/b 1 1 | 11.1619; 9.887; 18.6616 91.493; 90; 90 | 2058.75 | Kapustin, Eugene A.; Minkov, Vasily S.; Stare, Jernej; Boldyreva, Elena V. One Hydrogen Bond—Two Ways To Build a Structure. The Role of N‒H···O Hydrogen Bonds in Crystal Structures ofN,N-Dimethylglycine Crystal Growth & Design, 2014, 14, 1851 |
| 7206517 | CIF | C7 H8 O2 | P 21/b 1 1 | 8.1989; 11.5438; 14.516 113.323; 90; 90 | 1261.6 | Lemmerer, Andreas; Esterhuysen, Catharine OHphenol⋯OHalcohol hydrogen-bonding as the preferred hydrogen-bonded interaction in the crystal structures of three isomers of methylolphenol: analysis of hydrogen-bonding interactions in phenol and alcohol containing molecules CrystEngComm, 2011, 13, 5773 |
| 9011746 | CIF | Ca0.434 Fe0.052 H2 Mg0.88 Mn7.634 O18 Si4 | P 21/b 1 1 | 4.872; 10.669; 14.287 100.3; 90; 90 | 730.662 | Kato, T.; Ito, Y.; Hashimoto, N. The crystal structures of sonolite and jerrygibbsite Neues Jahrbuch fur Mineralogie, Monatshefte, 1989, 1989, 410-430 |
| 9014073 | CIF | Ca9 F0.784 H1.2 O17.216 Si4 | P 21/b 1 1 | 5.0672; 11.3545; 15.3941 100.587; 90; 90 | 870.63 | Galuskin, E. V.; Lazic, B.; Armbruster, T.; Galuskina, I. O.; Pertsev, N. N.; Gazeev, V. M.; Wlodyka, R.; Dulski, M.; Dzierzanowski, P.; Zadov, A. E.; Dubrovinsky, L. S. Edgrewite Ca9(SiO4)4F2-hydroxyledgrewite Ca9(SiO4)4(OH)2, a new series of calcium humite-group minerals from altered xenoliths in the ignimbrite of Upper Chegem caldera, Northern Caucasus, Kabardino-Balkaria, Russia American Mineralogist, 2012, 97, 1998-2006 |
| 9015226 | CIF | Ca9 F0.96 O17.04 Si4 | P 21/b 1 1 | 5.0687; 11.3579; 15.4004 100.598; 90; 90 | 871.474 | Galuskin, E. V.; Lazic, B.; Armbruster, T.; Galuskina, I. O.; Pertsev, N. N.; Gazeev, V. M.; Wlodyka, R.; Dulski, M.; Dzierzanowski, P.; Zadov, A. E.; Dubrovinsky, L. S. Edgrewite Ca9(SiO4)4F2-hydroxyledgrewite Ca9(SiO4)4(OH)2, a new series of calcium humite-group minerals from altered xenoliths in the ignimbrite of Upper Chegem caldera, Northern Caucasus, Kabardino-Balkaria, Russia American Mineralogist, 2012, 97, 1998-2006 |
| 9002774 | CIF | D0.9 F1.1 Mg5 O8.9 Si2 | P 21/b 1 1 | 4.7179; 10.2247; 7.829 109.01; 90; 90 | 357.067 | Friedrich, A.; Lager, G. A.; Ulmer, P.; Kunz, M.; Marshall, W. G. High-pressure single-crystal X-ray and powder neutron study of F,OH/OD-chondrodite: Compressibility, structure, and hydrogen bonding Sample: P = 1.26 GPa, Neutron American Mineralogist, 2002, 87, 931-939 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!