CPMD: Difference between revisions
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[http://www.cpmd.org/ Carr-Parrinello Molecular Dynamics] is a parallelized plane wave/pseudopotential implementation of Density Functional Theory, particularly designed for ''ab-initio'' molecular dynamics. | [http://www.cpmd.org/ Carr-Parrinello Molecular Dynamics] is a parallelized plane wave/pseudopotential implementation of Density Functional Theory, particularly designed for ''ab-initio'' molecular dynamics. | ||
[[Category: Materials modeling and Computer simulation codes]] | |||
Revision as of 16:58, 26 February 2007
Carr-Parrinello Molecular Dynamics is a parallelized plane wave/pseudopotential implementation of Density Functional Theory, particularly designed for ab-initio molecular dynamics.