1.2 Concepts and Terminology
LINK bondsThe ADF QM/MM Hybrid Potential
Nomenclature and Terminology
Full QM/MM system vs. QM model system
Link bonds and capping atoms
QM, MM and LI atom types
Atom types
QM/MM type or QM/MM atom type (MM, QM or LI)
Force Field atom type
ADF atoms or ADF fragments
Partitioning into QM and MM regions
