Dear developers and users,
I am wondering if it is possible to get MOs decomposition into contributions from different orbitals using Natural Population Analysis (NBO), as can be done with Mulliken analysis.
To be more clear I would like to get something like this but using NBO analysis.
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MULLIKEN POPULATION ANALYSIS (CAO-BASIS)
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BRUTTO POPULATIONS
values displayed are larger than 0.010000
atomic populations from total density:
atom charge n(s) n(p) n(d) n(f) n(g)
226sn 1.76136 2.79182 7.11688 10.32994
Thank you very much in advance for an answer or suggestions.
My best regards,
Jakub