Light-induced control of the spin distribution on Cu–dithiolene complexes: A correlated ab initio study

Metal dithiolene complexes—M(dmit)2—are key building blocks for magnetic, conducting, and optical molecular materials, with singular electronic structures resulting from the mixing of the metal and dmit ligand orbitals. Their use in the design of magnetic and conducting materials is linked to the co...

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Autores:
Tipo de recurso:
Fecha de publicación:
2019
Institución:
Universidad Tecnológica de Bolívar
Repositorio:
Repositorio Institucional UTB
Idioma:
eng
OAI Identifier:
oai:repositorio.utb.edu.co:20.500.12585/8723
Acceso en línea:
https://hdl.handle.net/20.500.12585/8723
Palabra clave:
CASSCF/CASPT2 calculations
Dmit radicals
Magnetism
Spin control
UV–Vis spectrum
Chemistry
Electron spin resonance
Light
Magnet
Magnetism
Quantum theory
Electron Spin Resonance Spectroscopy
Light
Magnetics
Magnets
Quantum theory
Rights
openAccess
License
http://creativecommons.org/licenses/by-nc-nd/4.0/