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[ 原始碼: cp2k  ]

套件:cp2k-data(8.1-9)

cp2k-data 的相關連結

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Ab Initio Molecular Dynamics (data files)

CP2K is a program to perform simulations of solid state, liquid, molecular and biological systems. It is especially aimed at massively parallel and linear scaling electronic structure methods and state-of-the-art ab-inito molecular dynamics (AIMD) simulations.

This package contains basis sets, pseudopotentials and force-field parameters.

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硬體架構 套件大小 安裝後大小 檔案
all 17,903。0 kB116,049。0 kB [檔案列表]