Editing ADF View (section)

== '''Model Hamiltonians''' ==

XC energy functionals and potentials
ADFinput: Select 'XC Functional' from the 'Model' Menu. Select the desired SCF potential from the 'xc
potential in SCF' menu. Select for METAGGA or hybrid functional energies after SCF the corresponding box
ADFUsersGuide: XC [1].
Relativistic effects (ZORA and spin-orbit coupling)
ADFinput: Select 'Relativity' from the 'Model' Menu.
Select 'None', 'Scalar, or 'Spin-Orbit' from 'Level of relativistic theory' menu.
ADFUsersGuide: relativity [1].
Solvents and other environments
ADFinput: COSMO: Select 'Solvation' from the 'Model' Menu. Select the checkbox 'Include solvation'.
ADFinput: QM/MM: Select 'Protein' from the 'Model' Menu. Select the 'Select' from the menu 'PDB-file'.
ADFinput: DRF and FDE: no direct GUI support.
ADFUsersGuide: COSMO [1], QM/MM [1,2], DRF [1], FDE [1].
Homogeneous electric field and point charges
ADFinput: Select 'Electric field' from the 'Model' Menu. Enter the values of the homogeneous electric field in
the menu 'Electric field - '. Enter the coordinates and values of the point charges in the text box.
ADFUsersGuide: EField [1]