Vibrational Analysis

flo fsch... at pci.uzh.ch
Mon Nov 12 16:36:19 UTC 2012


Hi Aaron,

to be precise there is no restart for the full NMA (where it would be 
actually most useful). The mode selective NMA has a restart and should give 
you in the limit of 3*Natom derivative calculations the same answer as the 
full NMA. Nevertheless, I will put it on my to do list, but can't promise 
when it will be implemented.

Cheers
Flo
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