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NEB Transition State Calculation
https://kuleuven.vasp.at/viewtopic.php?t=2193
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NEB Transition State Calculation
Posted:
Wed Dec 06, 2006 7:57 am
by
lcyin
"LSCALAPACK=.FALSE."
Is this setting necessary for NEB calculation?
NEB Transition State Calculation
Posted:
Thu Dec 07, 2006 6:21 am
by
admin
no