Accelerating the convergence of force calculations in electronic-structure computations.
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Biomedical subjects
KP Bohnen
Publications and source records attributed to KP Bohnen.
First-principles phonon and multiple-scattering electron-energy-loss-spectra studies of Cu(111) and Ag(111).
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Initial growth mode of Au on Ag(110) studied with first-principles calculations.
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Characterization of surface phonons on Cu(001) and Ag(001): First-principles phonon calculations with experimental and theoretical studies of high-resolution electron-energy-loss spectra.
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Model for the c(2 x 2) structure induced by K on Au(110).
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Phonon dispersion measurements and first-principles calculations for the Au(110) surface.
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Electron correlations in the ground state of silicon.
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Self-consistent calculation of the surface electronic structure of the (1 x 2) reconstructed Au(110) surface.
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Surface-phonon calculations for the Al(110) surface.
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Correlated ground state of diamond reexamined.
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Stability of the missing-row reconstruction on fcc (110) transition-metal surfaces.
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First-principles calculation of surface phonons on the Al(110) surface.
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Investigation of multilayer relaxation on Al(110) with the use of self-consistent total-energy calculations.
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