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STUDYING THE ELECTRONIC STRUCTURE OF TRINUCLEAR MOLYBDENUM CLUSTER SULFIDES WITH {Mo3S4} AND {Mo3S7} CORES BY X-RAY SPECTROSCOPY
- Source :
- Journal of Structural Chemistry. 62:853-864
- Publication Year :
- 2021
- Publisher :
- Pleiades Publishing Ltd, 2021.
-
Abstract
- A comprehensive study of the electronic structure of trinuclear molybdenum complexes (NH4)2[Mo3S13] and [Mo3S7(dtc)3]Br with cluster core {Mo3S7} and [Mo3S4(tu)8H2O]Cl4 complexes with cluster core {Mo3S4} is conducted by X-ray emission spectroscopy (XES), X-ray photoelectron spectroscopy (XPS), X-ray absorption near edge structure (XANES) spectroscopy, and quantum chemistry methods. Data were obtained on the partial atomic composition of the highest occupied molecular orbitals and unoccupied molecular orbitals and the nature of atomic interactions within cluster cores.
- Subjects :
- X-ray spectroscopy
Materials science
Electronic structure
010402 general chemistry
010403 inorganic & nuclear chemistry
01 natural sciences
XANES
0104 chemical sciences
Inorganic Chemistry
Crystallography
X-ray photoelectron spectroscopy
Materials Chemistry
Cluster (physics)
Molecular orbital
Density functional theory
Physical and Theoretical Chemistry
Spectroscopy
Subjects
Details
- ISSN :
- 15738779 and 00224766
- Volume :
- 62
- Database :
- OpenAIRE
- Journal :
- Journal of Structural Chemistry
- Accession number :
- edsair.doi...........93da0d0467fdb8474fb0ff2c7b29cfc3
- Full Text :
- https://doi.org/10.1134/s0022476621060056