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Detailed Information URL: http://www.cpmd.org/cpmd.html Title: Car-Parrinello Molecular Dynamics (CPMD) Description: Plane wave/pseudopotential implementation of Density Functional Theory, particularly designed for ab-initio molecular dynamics. Its first version was developed by Jurg Hutter at IBM Zurich Research Laboratory starting from the original Car-Parrinello codes. Free for non-profit organizations. Directory: Computers/Programming/Languages/Fortran/Source_Code/Physics | |||
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