Accurate Ground-State Energies of Solids and Molecules from Time-Dependent Density-Functional Theory
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چکیده
منابع مشابه
Semiclassical Correlation in Time-Dependent Density Matrix Functional Theory
The impact of time-dependent density functional theory (TDDFT) [1, 2] on calculations of excitation spectra and response in atoms, molecules, and solids is evident in its increasing use. In such applications a weak perturbation is applied to the system beginning in its ground state, and usually the exchange-correlation (xc) effects are treated with a ground-state approximation. Generally the re...
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تاریخ انتشار 2017