Q-Chem 5.0 User’s Manual
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11 Molecules in Complex Environments: Solvent Models, QM/MM and QM/EFP Features, Density Embedding
11.1 Introduction
11.2 Chemical Solvent Models
11.3 Stand-Alone QM/MM Calculations
11.4 Q-CHEM/CHARMM Interface
11.5 Effective Fragment Potential Method
11.6 Projector-based Density Embedding
11.7 Frozen-Density Embedding Theory based methods