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. - 1 online resource (xiv, 283 pages) : illustrations 24CM.
quantum mechanics
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.
9780470684429
Quantum chemistry.
Molecular structure.
Electrons.
Chimie quantique.
Structure mol�eculaire.
�Electrons.
molecular structure.
SCIENCE--Chemistry--Physical & Theoretical.
Electrons
Molecular structure
Quantum chemistry
QD462 / .M335
541/.03028 / M335
Methods of molecular quantum mechanics : An introduction to electronic molecular structure / Valerio Magnasco. - 1 online resource (xiv, 283 pages) : illustrations 24CM.
quantum mechanics
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.
9780470684429
Quantum chemistry.
Molecular structure.
Electrons.
Chimie quantique.
Structure mol�eculaire.
�Electrons.
molecular structure.
SCIENCE--Chemistry--Physical & Theoretical.
Electrons
Molecular structure
Quantum chemistry
QD462 / .M335
541/.03028 / M335