CHANGES OF VERSION 5.1.4
1.
BUGS
2. INPUT RELATED
CHANGES
1. BUGS
- fixed
bug in occ_diag_scal.f90p. The eigenvalue array was not broadcasted from proc.
0.
-
fixed problems in paratec/Makefile
for handling the make dist-pub option.
-
fixed thomas Fermi mixing to
handle systems with small negative charge densities
2. INPUT
related changes
- added
option to create supercells with the super_cell keyword and super_cell_vac.