Continuum remover-complex absorbing potential: Efficient removal of the nonphysical stabilization points
Journal of Chemical Physics, ISSN: 0021-9606, Vol: 131, Issue: 21, Page: 211102
2009
- 42Citations
- 18Captures
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Article Description
By adding a negative imaginary potential of variable strength η to the Hamiltonian, the resonance state of a system can be found as complex energy stabilized points in the η-trajectories of the eigenvalues. One problem that arises in practical calculations is the appearance of nonphysical complex energy stabilized points. A new method for separating the physical from the nonphysical complex energy stabilized points is proposed. The method is best illustrated with strongly correlated two-electron systems. © 2009 American Institute of Physics.
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AIP Publishing
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