A talk given by Ansgar Schaefer studying convergence behaviour in GPAW is here.
Using ASE Interactively
Setup To be able to use ASE interactively, setup environment variables as follows (assumes csh/tcsh):
...
A talk given by Ansgar Schaefer studying convergence behaviour in GPAW is here.
Setup To be able to use ASE interactively, setup environment variables as follows (assumes csh/tcsh):
...