Methods of molecular quantum mechanics : an introduction to electronic molecular structure /
Magnasco, Valerio.
Methods of molecular quantum mechanics : an introduction to electronic molecular structure / Valerio Magnasco. - Chichester, U.K. : Wiley, 2009. - 1 online resource (xiv, 283 pages) : illustrations
Includes bibliographical references and indexes.
Principles -- Matrices -- Atomic Orbitals -- Variation Method -- Spin -- Antisymmetry of Many-Electron Wavefunctions -- Self-consistent-field Calculations and Model Hamiltonians -- Post-Hartree-Fock Methods -- Valence Bond Theory and the Chemical Bond -- Elements of Rayleigh-Schroedinger Perturbation Theory -- Atomic and Molecular Interactions -- Symmetry.
This provides an advanced text introducing graduate students to the mathematical foundations of methods needed to do working applications in molecular quantum mechanics. It contains a consistent use of atomic units from the very beginning for simplifying mathematical formulae, and presents a unified presentation of basic elements of atomic and molecular interactions, with particular emphasis on practical use of second-order calculation techniques.
9780470684542 0470684542 9780470684559 0470684550 0470684429 9780470684429 0470684410 9780470684412
10.1002/9780470684559 doi
10.1002/9780470684559 Wiley InterScience http://www3.interscience.wiley.com
Quantum chemistry.
Molecular structure.
Electrons.
Electrons.
Molecular structure.
Quantum chemistry.
Quantum theory.
Electronic books.
QD462 / .M335 2009eb
541/.28
Methods of molecular quantum mechanics : an introduction to electronic molecular structure / Valerio Magnasco. - Chichester, U.K. : Wiley, 2009. - 1 online resource (xiv, 283 pages) : illustrations
Includes bibliographical references and indexes.
Principles -- Matrices -- Atomic Orbitals -- Variation Method -- Spin -- Antisymmetry of Many-Electron Wavefunctions -- Self-consistent-field Calculations and Model Hamiltonians -- Post-Hartree-Fock Methods -- Valence Bond Theory and the Chemical Bond -- Elements of Rayleigh-Schroedinger Perturbation Theory -- Atomic and Molecular Interactions -- Symmetry.
This provides an advanced text introducing graduate students to the mathematical foundations of methods needed to do working applications in molecular quantum mechanics. It contains a consistent use of atomic units from the very beginning for simplifying mathematical formulae, and presents a unified presentation of basic elements of atomic and molecular interactions, with particular emphasis on practical use of second-order calculation techniques.
9780470684542 0470684542 9780470684559 0470684550 0470684429 9780470684429 0470684410 9780470684412
10.1002/9780470684559 doi
10.1002/9780470684559 Wiley InterScience http://www3.interscience.wiley.com
Quantum chemistry.
Molecular structure.
Electrons.
Electrons.
Molecular structure.
Quantum chemistry.
Quantum theory.
Electronic books.
QD462 / .M335 2009eb
541/.28