[AMBER] HELP in Emperical Valence bond model (EVB)

From: bijyalaxmi athokpam <bijyalaxmi.athokpam.gmail.com>
Date: Wed, 23 Sep 2015 14:25:54 +0530

Hello everyone

Can somebody inform me if AMBER allows a combination of exponential and
Gaussian functions to be used for defining the off-diagonal coupling terms
( V12 ) in EVB model. I know it allows a combination of Gaussian but not
sure about of a combination of exponential and Gaussian functions.

Thanks in advance
Bijyalaxmi
PhD.
Inorganic and Physical Chemistry Department
Indian Institute of Science
Bangalore
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Received on Wed Sep 23 2015 - 02:00:04 PDT
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