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1. CPMD CPMD Public

   Forked from CPMD-code/CPMD

   The CPMD code is a parallelized plane wave / pseudopotential implementation of Density Functional Theory, particularly designed for ab-initio molecular dynamics.

   Fortran 1

2. jacobi_pd jacobi_pd Public

   Forked from jewettaij/jacobi_pd

   a short, simple public-domain header-only C++ library for calculating eigenvalues and eigenvectors of real symmetric matrices

   C++

3. CPMD-Benchmarks CPMD-Benchmarks Public

   Forked from OpenCPMD/Benchmarks

   Benchmark input files for openCPMD