Author Topic: Calculation of Mulliken population  (Read 52 times)

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Offline subu

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Calculation of Mulliken population
« on: September 21, 2020, 09:24 »
How to calculate charge density from mulliken population ?

Offline Aadhityan

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Re: Calculation of Mulliken population
« Reply #1 on: September 22, 2020, 08:58 »
If you means the electron density...Then, it can be calculated from script generator directly.

Offline subu

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Re: Calculation of Mulliken population
« Reply #2 on: September 22, 2020, 23:33 »
I mean to say how can i calculate charge density with mulliken population analysis by viewing text representation data?