Article ID Journal Published Year Pages File Type
5390153 Chemical Physics Letters 2006 6 Pages PDF
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
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