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Generalized Moment Correction for Long-Ranged Electrostatics
[Image: see text] Describing long-ranged electrostatics using short-ranged pair potentials is appealing because the computational complexity scales linearly with the number of particles. The foundation of the approach presented here is to mimic the long-ranged medium response by cancelling electric...
Autores principales: | Stenqvist, Björn, Aspelin, Vidar, Lund, Mikael |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American
Chemical Society
2020
|
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7588037/ https://www.ncbi.nlm.nih.gov/pubmed/32315176 http://dx.doi.org/10.1021/acs.jctc.9b01003 |
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