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- W2000876809 abstract "Starting with a brief introduction to excited-state density functional theory, we present our method of constructing modified local density approximated (MLDA) energy functionals for the excited states. We show that these functionals give accurate results for kinetic energy and exchange energy compared to the ground state LDA functionals. Further, with the inclusion of GGA correction, highly accurate total energies for excited states are obtained. We conclude with a brief discussion on the further direction of research that include the construction of correlation energy functional and exchange potential for excited states." @default.
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- W2000876809 date "2012-11-05" @default.
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- W2000876809 title "Excited-state density functional theory" @default.
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- W2000876809 doi "https://doi.org/10.1088/1742-6596/388/1/012011" @default.
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