Working equation of LR-TD-DFT First-order polarization propagator approximation
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Abstract
We present the derivation of a new response method termed rst order po- larization propagator approximation. The electronic structure is given by a density functional representation. We provide a detailed derivation of the method along with explicit expressions for the relevant integrals and matrix elements.
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- europepmc
- last seen: 2026-05-19T01:45:01.086888+00:00
- unpaywall
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