eLxr packages [ bianca ]
[ Fonte: cp2k ]
Pacote: cp2k-data (2025.1-1.1)
Links para cp2k-data
Baixe o pacote-fonte cp2k:
Mantenedores(as):
Fontes externas:
- Pagina principal [www.cp2k.org]
Pacotes similares:
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.
Download de cp2k-data
| Arquitetura | Tamanho do pacote | Tamanho instalado | Arquivos |
|---|---|---|---|
| all | 31,274.4 kB | 302,639.0 kB | [lista de arquivos] |