[ 原始碼： cp2k ]
套件： cp2k-data (6.1-3ubuntu2)
cp2k-data 的相關超連結
Trisquel 的資源：
下載原始碼套件 cp2k：
維護者：
Original Maintainers:
- Debichem Team (郵件存檔)
- Michael Banck
外部的資源：
- 主頁 [www.cp2k.org]
相似套件：
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.