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Lecture
Hartree-Fock Methods: Types and Performance
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Coupled Cluster Theory: Size Consistency
Explores the Coupled Cluster theory, discussing Size Extensivity, Size Consistency, and post-Hartree-Fock methods.
Hartree-Fock Equations: HeH+ Implementation
Covers the implementation of Hartree-Fock equations for HeH+ molecule, including theory, terms, orbitals, and self-consistent field calculation.
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Explores different types of basis sets, polarization functions, and accuracy challenges in computational chemistry.
Hartree-Fock Method: Basis Set Superposition Error and CP Correction
Explores the Hartree-Fock method, emphasizing basis set errors and CP correction.
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Hartree-Fock Equations: Derivation and Solutions
Explains the derivation of Hartree-Fock equations and their solutions iteratively.
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Covers the Density Functional Theory, including the Hartree-Fock method and the Kohn-Sham scheme.
Hartree-Fock Method: Theory and Applications
Explores the Hartree-Fock method in quantum chemistry, emphasizing the variational principle and self-consistent solutions.
Basis Sets: Types and Functional Forms
Explores basis sets in quantum chemistry, covering STOs, GTOs, and contracted Gaussian-Type Orbitals.