Molecular Properties, Wavefunction Analysis, and Interfaces to Visualization Tools
Topics
[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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