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Lecture Notes in Computational Chemistry: Electronic Structure Theory

Author: Jurg Hutter
Url: http://www.pci.uzh.ch/teaching/Download/pcv.pdf
Format: Pdf
Year: 2005
Category: Computational Chemistry
Pages: 152
Clicks: 274

Contents: Basic Quantum Mechanics; Basic Mathematical Review; Molecular Hamiltonian; Two-Electron Systems and Spin; Hartree{Fock Approximation; Molecular Orbital Theory; Correlation Energy; Coupled Cluster Approaches; Moller-Plesset Perturbation Theory; Density Functional Theory: Part I; Density Functional Theory: Part II, Density Functional Theory: Part III; Molecular Properties; NMR Chemical Shielding

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