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filippi-claudia / champ

The Cornell-Holland Ab-initio Materials Package (CHAMP) is a quantum Monte Carlo suite of programs for electronic structure calculations of atomic and molecular systems.
GNU General Public License v3.0
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fix missing CMake entries #267

Closed EmielSlootman closed 1 year ago

EmielSlootman commented 1 year ago

This should fix the bug that made the parsing take ages. Courtesy to Ravindra

filippi-claudia commented 1 year ago

Thanks Emie! Does this fix also the DMC being slow?

EmielSlootman commented 1 year ago

No, MPI barrier in DMC is still slow