Introduction to Relativistic Quantum Chemistry

ISBN: 9780195140866 出版年：2007 页码：545 Dyall, Kenneth G Faegri, Knut Jr Oxford University Press

This book introduces relativistic methods in quantum chemistry to non-experts and students. Its five sections cover classically relativity background; the Dirac question; four component methods, including symmetry, correlation, and properties; approximate methods, including perturbation theory, transformed Hamiltonians, regular approximations, matrix approximations, and pseudopotential methods; and an overview of relativistic effects on bonding.