A carregar...
Modeling quantum nuclei with perturbed path integral molecular dynamics
The quantum nature of nuclear motions plays a vital role in the structure, stability, and thermodynamics of molecules and materials. The standard approach to model nuclear quantum fluctuations in chemical and biological systems is to use path-integral molecular dynamics. Unfortunately, conventional...
Na minha lista:
| Publicado no: | Chem Sci |
|---|---|
| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Royal Society of Chemistry
2016
|
| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5975916/ https://ncbi.nlm.nih.gov/pubmed/29910893 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c5sc03443d |
| Tags: |
Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!
|