Synthesis, Structural, Thermal, and Electronic Properties of Palmierite-Related Double Molybdate ?-Cs2Pb(MoO4)2.

Title Synthesis, Structural, Thermal, and Electronic Properties of Palmierite-Related Double Molybdate ?-Cs2Pb(MoO4)2.
Authors S.F. Solodovnikov; V.V. Atuchin; Z.A. Solodovnikova; O.Y. Khyzhun; M.I. Danylenko; D.P. Pishchur; P.E. Plyusnin; A.M. Pugachev; T.A. Gavrilova; A.P. Yelisseyev; A.H. Reshak; Z.A. Alahmed; N.F. Habubi
Journal Inorg Chem
DOI 10.1021/acs.inorgchem.6b02653
Abstract

Cs2Pb(MoO4)2 crystals were prepared by crystallization from their own melt, and the crystal structure has been studied in detail. At 296 K, the molybdate crystallizes in the low-temperature ?-form and has a monoclinic palmierite-related superstructure (space group C2/m, a = 2.13755(13) nm, b = 1.23123(8) nm, c = 1.68024(10) nm, ? = 115.037(2)°, Z = 16) possessing the largest unit cell volume, 4.0066(4) nm(3), among lead-containing palmierites. The compound undergoes a distortive phase transition at 635 K and incongruently melts at 943 K. The electronic structure of ?-Cs2Pb(MoO4)2 was explored by using X-ray emission spectroscopy (XES) and X-ray photoelectron spectroscopy methods. For ?-Cs2Pb(MoO4)2, the photoelectron core-level and valence-band spectra and the XES band representing the energy distribution of Mo 4d and O 2p states were recorded. Our results allow one to conclude that the Mo 4d and O 2p states contribute mainly to the central part and at the top of the valence band, respectively, with also significant contributions throughout the whole valence-band region of the molybdate under consideration.

Citation S.F. Solodovnikov; V.V. Atuchin; Z.A. Solodovnikova; O.Y. Khyzhun; M.I. Danylenko; D.P. Pishchur; P.E. Plyusnin; A.M. Pugachev; T.A. Gavrilova; A.P. Yelisseyev; A.H. Reshak; Z.A. Alahmed; N.F. Habubi.Synthesis, Structural, Thermal, and Electronic Properties of Palmierite-Related Double Molybdate ?-Cs2Pb(MoO4)2.. Inorg Chem. 2017;56(6):32763286. doi:10.1021/acs.inorgchem.6b02653

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