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12 Fragment-Based Methods

• 12.1 Introduction
• 12.2 Specifying Fragments in the $molecule Section
• 12.3 FRAGMO Initial Guess for SCF Methods
• 12.4 Locally-Projected SCF Methods
• 12.5 Energy Decomposition and Charge-Transfer Analysis
• 12.6 Job Control for Locally-Projected SCF Methods
• 12.7 The Explicit Polarization (XPol) Method
• 12.8 Symmetry-Adapted Perturbation Theory (SAPT)
• 12.9 The XPol+SAPT (XSAPT) Method
• 12.10 The Many-Body Expansion Method
• 12.11 Ab-Initio Frenkel Davydov Exciton Model (AIFDEM)
• 12.12 TDDFT for Molecular Interactions