issues with M06-2X dispersion / aug-cc-pVTZ optimization

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Forum Vet

2:19:41 PM PST - Thu, Feb 7th 2013
Quote: Should I keep the memory statement in the restart input? Yes, You need to keep the memory statement in the restart input file. Otherwise, NWChem will use the default memory allocation that is not enough for your input file. Cheers, Edo