You are not logged in, therefore you can only see 100 materials. Registration is free and unlocks all 40935 materials: Register or Log in

100 results (register for free to see all 40935 materials)

ID (OMDB) ⇅ ID (COD) ⇅ Formula ⇅ Space group H-M ⇅ Space group IT ⇅ Publication details Publisher ↑
22935 2230093 C15 H15 Hf P 63/m 176 Tris(\h^5^-cyclopentadienyl)hafnium(III) Acta Crystallographica Section E, 2011, vol: 67, page: m629
31655 2213742 C12 H11 N O2 P 1 21/n 1 14 1-(5-Methyl-3-phenylisoxazol-4-yl)ethanone Acta Crystallographica Section E, 2007, vol: 63, page: o3010
33458 2217503 C14 H7 N3 O3 P 1 21/n 1 14 3-(2-Nitrophenoxy)phthalonitrile Acta Crystallographica Section E, 2008, vol: 64, page: o356
30131 2236287 C10 H10 Br2 N2 P 1 21/c 1 14 Redetermination of 2,2'-bipyridine-1,1'-diium dibromide Acta Crystallographica Section E, 2012, vol: 68, page: o3033
22196 2222329 C6 H7 N3 O2 P 1 21/n 1 14 4-Methyl-3-nitropyridin-2-amine Acta Crystallographica Section E, 2009, vol: 65, page: o1615
32702 2226811 C11 H10 Cl N P 1 21/c 1 14 4-Chloro-2,5-dimethylquinoline Acta Crystallographica Section E, 2010, vol: 66, page: o2020
31687 2214055 C9 H9 N O4 P 1 21/c 1 14 3,4-Dihydroxybenzoic acid acetonitrile solvate at 120 K Acta Crystallographica Section E, 2007, vol: 63, page: o3289
32466 2223676 C6 H10 N4 O6 C 1 2/c 1 15 1,3-Phenylenediammonium dinitrate Acta Crystallographica Section E, 2009, vol: 65, page: o2601
24288 2240558 C5 H10 Cl N3 P 1 21/n 1 14 Crystal structure of 2-(1H-imidazol-4-yl)ethanaminium chloride Acta Crystallographica Section E, 2015, vol: 71, page: o301
19941 2215126 C13 H14 O S P -1 2 3-Butyl-1H-isochromene-1-thione Acta Crystallographica Section E, 2007, vol: 63, page: o3708

Is your relevant material missing?

  • We can share our experience running high-throughput calculations based on density functional theory.
  • Alternatively, our machine learning models trained on our large database can predict relevant material properties.

Feel free to contact us if you are interested in a partnership so that we can provide computationally relevant results.
Please email us at:

diracmaterials@gmail.com