Subject: ESP charge in ADF

From: "tianxiao young" <[email-masked]>
Date: Fri, 10 Aug 2001 02:29:46 +0000

Dear CCLers,

Does anyone know how to calculate the ESP or CHelpG charge
using ADF program? Because the Mulliken charge seems to be
underestimating the polarization in the actinide complexes, I
need to use the ESP or CHelpG charge. Your response will be greatly 
appreciated.

Thank you very much in advance.

Tianxiao Yang

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