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#1 2017-11-16 12:17:02
- rizwan
- Member
- Registered: 2016-08-26
- Posts: 6
Electrostatic Potential (ESP)
How can we generate Electrostatic Potential (ESP) form Molcas calculations?
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#2 2017-11-16 17:03:49
- Ignacio
- Administrator
- From: Uppsala
- Registered: 2015-11-03
- Posts: 1,085
Re: Electrostatic Potential (ESP)
Check the EPOT keyword in GATEWAY.
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