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2.10 More Analysis

If you are interested in the DOS or a partitioning of the DOS or a partitioning of the DOS, look for the description of the keys DOS, GrossPopulations for partial DOS, and OverlapPopulations for overlap DOS.

The eigen system can be printed with Print Eigens and the Mulliken populations per orbital per k-point can be printed with Print OrbPop.

A list of the basis functions will be printed with Print OrbLabels.

Charges
Bader Analysis (AIM)
Density of States
DOS
Gross populations
Overlap populations
Form factors
Fragments
Fragment key
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