SSCHAcode / python-sscha

The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
GNU General Public License v3.0
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Symmetries in the supercell with Q-space symmetrization #81

Open mesonepigreco opened 2 years ago

mesonepigreco commented 2 years ago

The symmetrization using SPGLIB should be implemented in Q space as the espresso one, which is way faster.