GPAW Convergence Behavior
A talk given by Ansgar Schaefer studying convergence behaviour in GPAW is here (pdf).
Using ASE Interactively
Setup environment variables as follows (assumes csh/tcsh):
source /afs/slac/g/suncat/gpaw/setupenv
A talk given by Ansgar Schaefer studying convergence behaviour in GPAW is here (pdf).
Setup environment variables as follows (assumes csh/tcsh):
source /afs/slac/g/suncat/gpaw/setupenv