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 Date: 2012-02-08 05:18:35Science SIESTA Electronic band structure Hybrid functional Ab initio Molecular dynamics CP2K CONQUEST PSI Density functional theory Physics Chemistry |
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Date: 2012-02-08 05:18:35Science SIESTA Electronic band structure Hybrid functional Ab initio Molecular dynamics CP2K CONQUEST PSI Density functional theory Physics Chemistry |
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Research Networking Programme Advanced Concepts in ab-initio Simulations of Materials (Psi-k2) Standing Committee for Physical and Engineering Sciences (PESC)