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new functionals+dispersion correction
Jonas Baltrusaitis
jonas-baltrusaitis@uiowa.edu
Just looked at the gamess manual (fresh, January 13th), they have bunch of new functionals implemented (m0x family, pbe0, dispersion corrections etc). I was wondering if firefly broke off before, during or after those got implemented, e.g. can I use their manual to define those new functionals in the firefly input or firefly does not have those?
thanks
Jonas
Sun Feb 1 '09 5:04am
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