Isothermal reverse water gas shift chemical looping on La0.75Sr0.25Co(1−)Fe O3 perovskite-type oxides

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Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

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Revised effective ionic radii and systematic studies of interatomic distances in halides and chalcogenides

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Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 63.2K citations · Full text

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<i>Ab initio</i>molecular dynamics for liquid metals

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