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Model Hamiltonians
Model Hamiltonians
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Density Functional (XC)
LDA/GGA/metaGGA
Dispersion Correction
Model Potentials
Non-Collinear Approach
LibXC Library Integration
Hartree-Fock
Range-separated hybrid functionals
Double hybrids, MP2 and RPA
Defaults and special cases
GGA+U
OEP
DFT-1/2
Relativistic Effects and Spin
Spin polarization
Relativistic Effects
Solvation
COSMO: Conductor like Screening Model and the Solvation-key
Additional keys for periodic systems
SM12: Solvation Model 12
Electric and Magnetic Fields
Electric Field
Magnetic Field
Atom-wise fuzzy potential
Nuclear Model