SSCHAcode / python-sscha

The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
GNU General Public License v3.0
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The save_bin of ensemble does not save all the info #27

Open mesonepigreco opened 4 years ago

mesonepigreco commented 4 years ago

For example, the temperature at which the ensemble has been generated is not saved, this could be a problem if one does not recall the temperature used for the ensemble generation. In principle, it could be recomputed (with a stochastic error), but in that case, I think some statistical issues on error could matter.