FunThEMaS: Fundamental Theoretical and Experimental Materials Science
Tulane University
Nueva Orleans, Estados UnidosPublicacións en colaboración con investigadores/as de Tulane University (17)
2001
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Exploring the adiabatic connection between weak- and strong-interaction limits in density functional theory
International Journal of Modern Physics B
2000
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Comment on “Correlation holes in a spin-polarized dense electron gas”
Physical Review B - Condensed Matter and Materials Physics, Vol. 62, Núm. 3, pp. 2227-2231
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Density functional for short-range correlation: Accuracy of the random-phase approximation for isoelectronic energy changes
Physical Review B - Condensed Matter and Materials Physics, Vol. 61, Núm. 24, pp. 16430-16439
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Density functionals for the strong-interaction limit
Physical Review A - Atomic, Molecular, and Optical Physics, Vol. 62, Núm. 1, pp. 012502-012501
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Density functionals for the strong-interaction limit
Physical Review A - Atomic, Molecular, and Optical Physics, Vol. 62, Núm. 1, pp. 15
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Density-functional versus wave-function methods: Toward a benchmark for the jellium surface energy
Physical Review B - Condensed Matter and Materials Physics, Vol. 61, Núm. 4, pp. 2595-2598
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Exchange-correlation energy of the non-uniformly scaled hydrogen atom
Journal of Molecular Structure: THEOCHEM, Vol. 501-502, pp. 189-194
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Optimized effective potential method for polymers
Journal of Chemical Physics, Vol. 112, Núm. 17, pp. 7355-7362
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Role of the Exchange-Correlation Energy: Nature's Glue
International Journal of Quantum Chemistry, Vol. 77, Núm. 5, pp. 814-818
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Simulation of all-order density-functional perturbation theory, using the second order and the strong-correlation limit
Physical Review Letters, Vol. 84, Núm. 22, pp. 5070-5073
1999
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Accurate density functional with correct formal properties: A step beyond the generalized gradient approximation
Physical Review Letters, Vol. 82, Núm. 12, pp. 2544-2547
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Density-functional correction of random-phase-approximation correlation with results for jellium surface energies
Physical Review B - Condensed Matter and Materials Physics, Vol. 59, Núm. 16, pp. 10461-10468
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Local density approximation for superconductors
Physical Review Letters, Vol. 83, Núm. 13, pp. 2628-2631
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Molecular and solid-state tests of density functional approximations: LSD, GGAs, and Meta-GGAs
International Journal of Quantum Chemistry, Vol. 75, Núm. 4-5, pp. 889-909
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Orbital dependent exchange-only methods for periodic systems
Physical Review B - Condensed Matter and Materials Physics, Vol. 60, Núm. 8, pp. 5429-5439
1998
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Density functionals from LDA to GGA
Computational Materials Science, Vol. 11, Núm. 2, pp. 122-127
1996
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Transferability of a local pseudopotential based on solid-state electron density
Journal of Physics Condensed Matter, Vol. 8, Núm. 3, pp. 287-302