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Density-Functional Theory for Time-Dependent Systems
, 1984E. Runge, E. Gross
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Conceptual density functional theory: status, prospects, issues
Theoretical Chemistry accounts, 2020P. Geerlings +9 more
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2011
A short overview is given of fundamentals of the modern Density Functional Theory (DFT), an alternative approach to the quantum many-body problem. Basic theorems of Hohenberg and Kohn (HK) are summarized and their extensions for general densities and mixed quantum states are outlined, with the ensemble formulation covering the open molecular systems at
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A short overview is given of fundamentals of the modern Density Functional Theory (DFT), an alternative approach to the quantum many-body problem. Basic theorems of Hohenberg and Kohn (HK) are summarized and their extensions for general densities and mixed quantum states are outlined, with the ensemble formulation covering the open molecular systems at
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2014
Even with restriction to the longitudinal contribution the treatment of the electron-electron interaction is exceedingly difficult. However, in the case of the ground state any energetic, structural or electronic property of an inhomogeneous electron gas can be viewed as a functional of its local density \(n({\mathbf {x}})\).
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Even with restriction to the longitudinal contribution the treatment of the electron-electron interaction is exceedingly difficult. However, in the case of the ground state any energetic, structural or electronic property of an inhomogeneous electron gas can be viewed as a functional of its local density \(n({\mathbf {x}})\).
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SARS-CoV-2 variants, spike mutations and immune escape
Nature Reviews Microbiology, 2021William T Harvey +2 more
exaly