Subject: External pertubation term

From: "Nguyen N. Anh" <[email-masked]>
Date: Thu, 15 Feb 1996 10:36:38 -0500

Dear Netters,

A question to the Gaussian users out there:

In MO theory, the electrostatic effect may be taken as an additional term,
H1(one-electron operator), in the Hamiltonian of the unperturbed molecule,H0:
  Heff= H0 + H1

With the available g94 routines, what is the simplest way to compute the 1e
integrals of H1?

Many thanks in advance,

-- 
Nguyen Nam Anh   Graduate student
E-mail: [email-masked]
WWW: http://promethium.chm.ulaval.ca/~anh/