Molecular Properties, Wavefunction Analysis, and Interfaces to Visualization Tools


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[1] How to generat file47 for gennbo (NBO7)

[2] Population analysis new vs old (moloch)

[3] [HowTo] Generate NTOs from TDDFT

[4] Create wfn file with natural orbitals for Multiwfn

[5] freeH partition function calculation

[6] Mulliken Populations and Orbital Contributions

[7] transdens

[8] TDDFT-Transition densities

[9] Smaller grid for calculation of electron density


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