Kohn-Sham effective potentials for spin-polarized atomic systems.
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Biomedical subjects
JB Krieger
Publications and source records attributed to JB Krieger.
Kohn-Sham calculations with self-interaction-corrected local-spin-density exchange-correlation energy functional for atomic systems.
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Capacitive nature of atomic-sized structures.
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Self-consistent calculations of atomic properties using self-interaction-free exchange-only Kohn-Sham potentials.
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Systematic approximations to the optimized effective potential: Application to orbital-density-functional theory.
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Construction and application of an accurate local spin-polarized Kohn-Sham potential with integer discontinuity: Exchange-only theory.
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Band-structure calculations of noble-gas and alkali halide solids using accurate Kohn-Sham potentials with self-interaction correction.
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Self-consistency test for the exchange-only Kohn-Sham potential.
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Construction and application of gradient-expansion approximations for exchange energy with self-interaction correction.
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Ground-state energies and highest occupied eigenvalues of atoms in exchange-only density-functional theory.
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Quantum transport for Bloch electrons in inhomogeneous electric fields.
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Accurate orbital-independent density-functional potential including self-interaction correction.
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Exchange-only density-functional theory in an exactly soluble model.
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Reply to "Comment on 'Time evolution of Bloch electrons in a homogeneous electric field' "
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Quantum transport for Bloch electrons in a spatially homogeneous electric field.
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Time evolution of Bloch electrons in a homogeneous electric field.
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Test of density-functional approximations in an exactly soluble model.
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