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This folder contains main references for CPMD.
General bibliographical references for CPMD
References and credits for major developments
Original paper on the Car-Parrinello method
Linear scaling geometry optimizer
Dual-level parallelization, Taskgroups parallelization and Distributed linear algebra
Finite Temperature DFT
Ab Initio Path Integral Molecular Dynamics
Ab Initio Constrained Molecular Dynamics
Ab Initio Molecular Dynamics with controlled pressure
Dipole Moment in periodic systems and Wannier Functions
Molecular dynamics in low-spin excited states
Response Functions calculations , NMR and IR
Time Dependent DFT
Max Planck Institute, Stuttgart.
It is distributed free of charge to non-profit Organizations under the
CPMD Free License.