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B AOInts

• B.1 Introduction
• B.2 Historical Perspective
• B.3 AOInts: Calculating ERIs with Q-Chem
• B.4 Shell-Pair Data
• B.5 Shell-Quartets and Integral Classes
• B.6 Fundamental ERI
• B.7 Angular Momentum Problem
• B.8 Contraction Problem
• B.9 Quadratic Scaling
• B.10 Algorithm Selection
• B.11 More Efficient Hartree–Fock Gradient and Hessian Evaluations
• B.12 User-Controllable Variables