Localization of excess electrons in cubic NanClm clusters.
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Biomedical subjects
MR Pederson
Publications and source records attributed to MR Pederson.
New theoretical model for the diamond 1s core exciton.
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Electronic structure of crystalline K6C60.
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Theory of magnetic and structural ordering in iron clusters.
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Local-density-approximation-based simulations of hydrocarbon interactions with applications to diamond chemical vapor deposition.
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Pseudoenergies for simulations on metallic systems.
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First-principles calculations of defect-induced lattice relaxation in ionic systems.
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Accurate forces in a local-orbital approach to the local-density approximation.
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Donor levels and impurity-atom relaxation in nitrogen- and phosphorus-doped diamond.
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First-principles, general-potential local-orbital calculations for bulk crystals.
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Variational mesh for quantum-mechanical simulations.
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Metallic state of the free-electron gas within the self-interaction-corrected local-spin-density approximation.
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Simulated annealing with floating Gaussians: Hellmann-Feynman forces without corrections.
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Improved theoretical methods for studies of defects in insulators: Application to the F center in LiF.
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All-electron self-consistent variational method for Wannier-type functions: Applications to the silicon crystal.
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