msspec_python3/src
Sylvain Tricot cedbfd823e Fix bugs for energy scan in EIG spectroscopy.
It was impossible to perform an energy scan in EIG spectroscopy.
The calculator and calcio modules were corrected.
We can now compute the spectral radius vs energy with and without
renormalization for EIG spectroscopy mode
The G_n, Sigma_n, Z_n and Lowdin K^2 methods are supported for
the inversion algorithm.

This commit fixes also several issues in the GUI and in the
hemispherical_cluster function
2019-12-12 16:45:12 +01:00
..
msspec Fix bugs for energy scan in EIG spectroscopy. 2019-12-12 16:45:12 +01:00
MANIFEST.in Fix bug in install process. 2019-12-06 13:26:22 +01:00
Makefile Fix bugs for energy scan in EIG spectroscopy. 2019-12-12 16:45:12 +01:00
install.sh Fix bug in install script for the gfortran version 2019-11-29 15:33:45 +01:00
setup.py Work on continuous integration 2019-11-20 18:14:00 +01:00