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Modeling Ultrafast Electron Dynamics in Strong Magnetic Fields Using Real-Time Time-Dependent Electronic Structure Methods
[Image: see text] An implementation of real-time time-dependent Hartree–Fock (RT-TDHF) and current density functional theory (RT-TDCDFT) for molecules in strong uniform magnetic fields is presented. In contrast to earlier implementations, the present work enables the use of the RT-TDCDFT formalism,...
Autores principales: | Wibowo, Meilani, Irons, Tom J. P., Teale, Andrew M. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American
Chemical Society
2021
|
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8047917/ https://www.ncbi.nlm.nih.gov/pubmed/33724806 http://dx.doi.org/10.1021/acs.jctc.0c01269 |
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