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
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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