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Free-radical optimization in Mp2
gensz
genoffrie@gmail.com
i HAVE A PROBLEM RUNNING WITH A RADICAL IN MP2 BECAUSE IT'LL SAY "THE GRADIENT IS FOR RHF MP2 RUNS ONLY"HOW CAN I CHANGE THE GRADIENT SO THAT I CAN BE ABLE TO RUN WITH MP2? THANKS
Tue Feb 28 '12 4:12pm
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