Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5390153 | Chemical Physics Letters | 2006 | 6 Pages |
Abstract
Using a second quantization representation of the Hamiltonian, an operator representation is derived which corresponds to the indicated partitioning of the CI-matrix in excitation degrees. This gives rise to a new Rayleigh-Schrödinger perturbation theory which is of comparable quality as the well established Møller-Plesset and Coupled-Cluster methods.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Reinhold F. Fink,