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Lecture
Coupled Cluster Theory: Size Consistency
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Configuration Interaction II: Slater-Condon Rules
Covers the Slater-Condon rules for configuration interaction and determinants.
Editing Input Files in vi: Hartree-Fock Method and XYZ Format
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Quantum Chemical Electronic Structure Methods
Explores quantum chemical electronic structure methods, including basis sets and the Hartree-Fock method.
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Explores Basis Set Superposition Error in quantum chemistry calculations and the Counter-Poise correction to estimate it.
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Explores Post-HF methods like MPn and CI to include electron correlation effects neglected by HF.
Hartree-Fock Equations: Derivation and Solutions
Explains the derivation of Hartree-Fock equations and their solutions iteratively.
Hartree-Fock Method: Theory and Applications
Explores the Hartree-Fock method in quantum chemistry, emphasizing the variational principle and self-consistent solutions.
Hartree-Fock: Roothan Equations
Covers the Hartree-Fock Roothaan Equations and different types of Hartree-Fock methods, discussing their performance.
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Explores the Hartree-Fock method, basis sets, Slater determinants, and quantum chemistry concepts like spin contamination and Hund's rule.
Quantum Chemistry Fundamentals
Covers the basics of quantum chemistry and the Hartree-Fock method.