most citedVariational solution of congruent transformed Hamiltonian for many-electron systems using full configuration interaction calculation

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physics.chem-ph2012★ 11 cited

Variational solution of congruent transformed Hamiltonian for many-electron systems using full configuration interaction calculation

Jennifer M. Elward, Johannes Hoja, Arindam Chakraborty

The congruent transformation of the electronic Hamiltonian is developed to address the electron correlation problem in many-electron systems. The central strategy presented in this…