Software:cpmd

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Car-Parinello Molecular Dynamics (CPMD)

The CPMD code is a parallelized plane wave/pseudopotential implementation of Density Functional Theory, particularly designed for ab-initio Molecular Dynamics simulation as described by Car and Parinello. CPMD runs on many different computer architectures and it is well parallelized.
  • Related Software:
ADF
Amber
Gamess
NAMD
NWChem