New version 1.2
It's time for a new release of the SSCHA code.
This new version comes with a lot of improvements in the interface between client and server in the automatic cluster submission.
In particular, the code packs together all the configurations in tar files and reduces a lot the communications and the number of connections established.
The I/O has been strongly improved, and we added a new script to analyze the output.
sscha-plot-results.py NAME
To print on file the correct information during the minimization, use:
ioinfo = sscha.Utilities.IOInfo()
ioinfo.SetupSaving("NAME")
And pass ioinfo
as an argument of custom_function_post
of run (of sscha.SchaMinimizer.SSCHA_Minimizer) or of setup_custom_function (of sscha.Relax.SSCHA).
Thanks to @diegomartinez2 , the new version implements the SOBOL algorithm to reduce the number of configurations required to reach convergence.