If possible do the analysis in a single point run.
ADFoutput: Browse the output to find the complete analysis.
Fragments
ADFinput: Select MultiLevel → Fragments to use a fragment analysis.
Select MultiLevel → Regions to define the fragments.
Select all atoms that form a fragment. Press the '+' button to add a fragment.
ADFGUIReference: fragments [1]
ADFUsersGuide: fragments [1].
Bond energy analysis
ADFinput: No special input is needed.
ADFUsersGuide: bond energy analysis [1].
ETS-NOCV analysis
ADFinput: Select Details → ETS-NOCV.
Select 'Closed Shell' or 'Open Shell' for 'ETS-NOCV Analysis'.
ADFUsersGuide: ETS-NOCV [1].
Advanced charge density and MO analysis
ADFinput: Mulliken, VDD, Hirshfeld, MDC, MO Analysis: No special input is needed.
ADFinput: Bader Analysis: Select Properties → Bader Analysis.
Select the checkbox 'calculate Bader Atomic Properties'.
ADFinput: NBO Analysis: Select Properties → Orbitals.
Select the checkbox 'Perform NBO Analysis'.
ADFlevels: Energy diagram.
ADFview: Electron densities, potentials, MOs, ELF, etc.
ADFdos: Select an atom to see a GPDOS.
Select an atom and hold the mouse for a popup menu to select the GPDOS for S, P, D, or F functions.
ADFspectra: Select 'DOS' from the 'Spectra' Menu.
ADFUsersGuide: Mulliken [1],
Hirshfeld and Voronoy deformation density [1],
Bondorders [1],
Bader [1],
NBO [1].
Molecular symmetry
ADFinput: Possibility to symmetrize the molecule with the Symmetry button
(the star button).
ADFUsersGuide: symmetry [1,2].
