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Massively Parallel Quantum Chemistry Program (OpenMPI transitional package)


MPQC is an ab-inito quantum chemistry program. It is especially designed to compute molecules in a highly parallelized fashion.

This package merely depends on the main (MPI-enabled) mpqc package.

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54 other people were interested in this package here. The newest known version of this software is 2.3.1-17 (Information last updated 1 day ago.)