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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...
Uloženo v:
| Vydáno v: | J Chem Theory Comput |
|---|---|
| Hlavní autoři: | , , |
| Médium: | Artigo |
| Jazyk: | Inglês |
| Vydáno: |
American
Chemical Society
2020
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| On-line přístup: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7588037/ https://ncbi.nlm.nih.gov/pubmed/32315176 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jctc.9b01003 |
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