Difference between revisions of "QMCPACK"
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Revision as of 17:09, 7 May 2018
Description
QMCPACK is an open-source production level many-body ab initio Quantum Monte Carlo code for computing the electronic structure of atoms, molecules, and solids.
Environment Modules
Run module spider qmcpack to find out what environment modules are available for this application.
System Variables
- HPC_{{#uppercase:qmcpack}}_DIR - installation directory
- HPC_{{#uppercase:qmcpack}}_BIN - executable directory