Author Topic: Is NBO analysis possible for PBC systems using riper  (Read 951 times)

naustin1

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Is NBO analysis possible for PBC systems using riper
« on: November 22, 2016, 05:37:27 pm »
Hello,

Is it possible to perform NBO analysis on a periodic system using riper?
I added $pop nbo to the TURBOTEST/MGO.RIPER.3D.SCF
but I didn't see any nbo analysis in the riper outfile after running riper >& riper.out

Does that mean nbo isn't included or a different keyword must be specified?

Thanks,

Natalie

turbomaster

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Re: Is NBO analysis possible for PBC systems using riper
« Reply #1 on: November 28, 2016, 05:07:12 am »
NBO is not yet implemented in the riper module.