載入...

Isotropic periodic sum for multipole interactions and a vector relation for calculation of the Cartesian multipole tensor

Isotropic periodic sum (IPS) is a method to calculate long-range interactions based on the homogeneity of simulation systems. By using the isotropic periodic images of a local region to represent remote structures, long-range interactions become a function of the local conformation. This function is...

全面介紹

Na minha lista:
書目詳細資料
發表在:J Chem Phys
Main Authors: Wu, Xiongwu, Pickard, Frank C., Brooks, Bernard R.
格式: Artigo
語言:Inglês
出版: AIP Publishing LLC 2016
主題:
在線閱讀:https://ncbi.nlm.nih.gov/pmc/articles/PMC5085978/
https://ncbi.nlm.nih.gov/pubmed/27802614
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4966019
標簽: 添加標簽
沒有標簽, 成為第一個標記此記錄!