Electronic excited states in deep variational Monte Carlo

Obtaining accurate ground and low-lying excited states of electronic systems is crucial in a multitude of important applications. One ab initio method for solving the Schrödinger equation that scales favorably for large systems is variational quantum Monte Carlo (QMC). The recently introduced deep Q...

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Detalles Bibliográficos
Autores principales: Entwistle, M. T., Schätzle, Z., Erdman, P. A., Hermann, J., Noé, F.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9845370/
https://www.ncbi.nlm.nih.gov/pubmed/36650151
http://dx.doi.org/10.1038/s41467-022-35534-5

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9845370/
https://www.ncbi.nlm.nih.gov/pubmed/36650151
http://dx.doi.org/10.1038/s41467-022-35534-5

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