The Pauli Exclusion Operator: example of Hooke's atom
Abstract
The Pauli Exclusion Operator (PEO) which ensures proper symmetry of the eigenstates of multi-electron systems with respect to exchange of each pair of electrons is introduced. Once PEO is added to the Hamiltonian, no additional constraints on multi-electron wave function due to the Pauli exclusion principle are needed. For two-electron states in two dimensions () the PEO can be expressed in a closed form in terms of momentum operators, while in the position representation PEO is a non-local operator. Generalizations of PEO for multi-electron systems is introduced. Several approximations to PEO are discussed. Examples of analytical and numerical calculations of PEO are given for isotropic and anisotropic Hooke's atom in~. Application of approximate and kernel forms of PEO for calculations of energies and states in~ Hooke's atom are analyzed. Relation of PEO to standard variational calculations with the use of Slater determinant is discussed.
Cite
@article{arxiv.2101.03445,
title = {The Pauli Exclusion Operator: example of Hooke's atom},
author = {Tomasz M. Rusin and Wlodek Zawadzki},
journal= {arXiv preprint arXiv:2101.03445},
year = {2021}
}
Comments
12 pages, 3 figures