Hohenberg-Kohn density-functional theory as an implicit Poisson equation for density changes from summed fragment densities.
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Biomedical subjects
AE DePristo
Publications and source records attributed to AE DePristo.
Mechanistic study of atomic desorption resulting from the keV-ion bombardment of fcc{001} single-crystal metals.
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Step-facilitated dissociation of small metal clusters: A molecular-dynamics study.
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Theoretical predictions of heats of formation of fcc binary transition-metal alloys using the corrected effective-medium theory.
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Corrected effective-medium study of metal-surface relaxation.
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Low-temperature epitaxial growth of thin metal films.
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Corrected effective-medium method. IV. Bulk cohesive and surface energies of second- and third-row metals and multilayer relaxation of Al, Fe, and Ni.
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Kinetic-energy functionals via Padé approximations.
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