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Chemical Institute of Rennes Inorganic Theoretical Chemistry
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Keywords
Mixed-valence
Electronic structure
Silver
Borides
Emission
Electronic properties
Molybdenum clusters
Tetrathiafulvalene
Semiconductor
Dyes
Electron counting
Dielectric confinement
DFT calculations
COSMO
Magnetic anisotropy
Band structure
Palladium
Quantum confinement
Transition metals
Silicon
Phase diagram
X-ray diffraction
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Fluorescence
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Cluster
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Copper
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Rhenium
Calculations
Uranium complexes
Isocyanurates
Coordination chemistry
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Iminopyridine
Crystal-structure
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NLO
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TD-DFT
Photophysics
Perovskites
Td-dft
Iron
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Ruthenium
Chromophores
Magnetism
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Neutron diffraction
Ab initio calculations
Hybrid perovskites
Photoluminescence
Superatom
Magnetic properties
Cluster compounds
Lanthanides
DFT calculation
Hydrides
Gold
Photovoltaics
Charge transfer
Superatoms
Nanoclusters
Halide perovskites
Spin-orbit coupling
Broken symmetry
Lanthanide
Computational chemistry
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GeTe
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Chemistry
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