2012
Crystal structure and formula revision of deliensite, Fe[(UO2)2(SO4)2(OH)2](H2O)7
PLÁŠIL, Jakub; Hauser JÜRG; Václav PETŘÍČEK; Meisser NICOLAS; Stuart MILLS et al.Základní údaje
Originální název
Crystal structure and formula revision of deliensite, Fe[(UO2)2(SO4)2(OH)2](H2O)7
Autoři
PLÁŠIL, Jakub; Hauser JÜRG; Václav PETŘÍČEK; Meisser NICOLAS; Stuart MILLS; Radek ŠKODA; Fejfarová KARLA; Jiří ČEJKA; Jiří SEJKORA; Jan HLOUŠEK; Johannet JEAN-MARC; Machovič VLADIMÍR a Lapčák LADISLAV
Vydání
Mineralogical Magazine, London, Mineralogical Society, 2012, 0026-461X
Další údaje
Jazyk
angličtina
Typ výsledku
Článek v odborném periodiku
Obor
10302 Condensed matter physics
Stát vydavatele
Velká Británie a Severní Irsko
Utajení
není předmětem státního či obchodního tajemství
Impakt faktor
Impact factor: 2.212
Označené pro přenos do RIV
Ano
Kód RIV
RIV/00216224:14310/12:00064480
Organizační jednotka
Přírodovědecká fakulta
UT WoS
Klíčová slova anglicky
Uranyl sulfate; crystal structure; phosphuranylite topology; Raman spectroscopy; infrared spectroscopy
Změněno: 24. 3. 2013 12:48, doc. Mgr. Radek Škoda, Ph.D.
Anotace
V originále
The crystal structure of deliensite, Fe[(UO2)2(SO4)2(OH)2](H2O)7, was solved by direct methods and refined to R1 = 6.24% for 5211 unique observed reflections [Iobs greater than 3sigma(I)], on a crystal that was found to consist of rotational and inversion (merohedral) twins, from Jeroným mine, Abertamy in the Czech Republic. The presence of four twin domains was taken into account in the refinement. The structure is orthorhombic, space group Pnn2, with unit-cell parameters a = 15.8514(9), b = 16.2478(7), c = 6.8943(3) A, V = 1775.6(1) A^3 and Z = 4. The crystal structure of deliensite contains uranyl-sulfate sheets with a phosphuranylite topology, consisting of dimers of edge-sharing uranyl pentagonal bipyramids linked by corner-sharing with sulfate tetrahedra. The sheets lie in the (100) plane and are decorated by [Fe2+O(H2O)5] octahedra; two weakly bonded H2O molecules are present in the interlayer. The [Fe2+O(H2O)5] octahedron is linked directly to the sheet via the uranyl oxygen atom. Adjacent sheets are linked by hydrogen bonds only. The sheet topology and geometrical isomerism is discussed and a comparison of the composition obtained from electron-probe microanalysis, powder-diffraction data, Raman and infrared spectra of deliensite samples from Mas d'Alary, Lodeve, France; L'Ecarpiere mine, Gétigné, France; and several localities at Jáchymov, Western Bohemia, Czech Republic is made