Closed NathanERa closed 2 years ago
Chenged exceptions and functionals test to take into account the new added GGA calculation option. Changed spin test to use GGA. Added a test for conductivity module.
Also please add a test for the Gram-Schmidt procedure at the end of staticKS.py.
staticKS.py
The rest seems to be awkward one-liners...
Chenged exceptions and functionals test to take into account the new added GGA calculation option. Changed spin test to use GGA. Added a test for conductivity module.