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Is Raman spectrum calculation highly computationally intensive?
Siddheshwar Chopra
sidhusai@gmail.com
Dear All,
I have never worked with Raman spectrum calculations using FIREFLY. Can anybody having experience with these calculations tell about their intensiveness of computations? It needs $HESS as noted from the manual.
Regards,
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Tue Feb 14 '17 11:35am
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