Author Topic: Obtaining the MO integrals (four-index transformation data)  (Read 5328 times)

rubcaspac60

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Obtaining the MO integrals (four-index transformation data)
« on: February 03, 2015, 11:03:59 AM »
Good day,

I am a newbi in this program and I am looking to obtian the integrals of selected MO.
Specifically, I am looking for the KS-orbital integrals, is there a module which can give them to me?, and how are the indexed?

Thank you very much.

christof.haettig

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Re: Obtaining the MO integrals (four-index transformation data)
« Reply #1 on: October 01, 2015, 10:54:00 AM »
For this information you need a developer license.