This volume contains review and research articles in one particular ar ea of quantum chemical methodology: the theory of electron correlation and the localization problem. Correlation energy (i.e., the energy be yond the Hartree-Fock) plays an important role in the theoretical desc ription of several chemical processes (reactions, excitations, ionizat ion) while localization in quantum chemistry usually emerges as a math ematical transformation of the wave function. The connection between t hese two issues is provided by the need to evaluate correlation energy for larger molecules, which is...
This volume contains review and research articles in one particular ar ea of quantum chemical methodology: the theory of electron correlation and the ...