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Is it possible to get HOMO-LUMO gap for a set of Temperature changes??
Siddheshwar Chopra
sidhusai@gmail.com
Dear Sir,
Can we obtain HOMO-LUMO gap data for a set of temperatures in FIREFLY? If I am not wrong I can also say "SIngle Point Energy" calculations for a set of Temperatures?Regards,
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Fri Feb 22 '13 2:52pm
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