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arxiv: cond-mat/0503038 · v1 · submitted 2005-03-02 · ❄️ cond-mat.other

Continuum states from time-dependent density functional theory

classification ❄️ cond-mat.other
keywords scatteringcontinuumdensityfunctionalstatestheorytime-dependentaccurate
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Linear response time-dependent density functional theory is used to study low-lying electronic continuum states of targets that can bind an extra electron. Exact formulas to extract scattering amplitudes from the susceptibility are derived in one dimension. A single-pole approximation for scattering phase shifts in three dimensions is shown to be more accurate than static exchange for singlet electron-He$^+$ scattering.

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