Ascalaph量子是一个Ascalaph接口程序。 Ascalaph是执行量子力学计算最初的分子模型的发展,分子力学和动力学模拟在气体或在凝聚相通用分子模拟软件。它可以与外部的分子建模软件包(MDynaMix,NWChem,CP2K,PC GAMESS /萤火虫和Delphi)进行交互。 Ascalaph昆腾提供到从头量子力学包NWChem,CP2K,和PC GAMESS /萤火虫。
- 主页
- Windows XP
- Ascalaph Quantum
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Ascalaph Quantum
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意见 Ascalaph Quantum
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