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Artificial Neural Networks as Mappings between Proton Potentials, Wave Functions, Densities, and Energy Levels
Artificial neural networks (ANNs) have become important in quantum chemistry. Herein, applications to nuclear quantum effects, such as zero-point energy, vibrationally excited states, and hydrogen tunneling, are explored. ANNs are used to solve the time-independent Schrödinger equation for single- a...
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| Publicado no: | J Phys Chem Lett |
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| Main Authors: | , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2021
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC8021271/ https://ncbi.nlm.nih.gov/pubmed/33630595 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpclett.1c00229 |
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