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- W2034144787 abstract "Tables of the summation constants required for the calculation of surface energies of perfect half-crystals with Lennard-Jones types of inverse-power pair potential functions have been calculated using an IBM 709 computer. The tables cover simple cubic, face-centered cubic, body-centered cubic, simple hexagonal, and hexagonal close-packed structures with face plane orientations having Miller indices up to 5 in some cases. The inverse powers included in the tabulation extend from 5 (the lowest power for which these sums converge) to 13. The applications of these results to the calculation of grain boundary energy and spacing and to the estimation of surface distortion in half-crystals according to methods previously developed by the author are pointed out. The energies of hcp and fcc close-packed surfaces are compared as an example." @default.
- W2034144787 created "2016-06-24" @default.
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- W2034144787 date "1961-05-01" @default.
- W2034144787 modified "2023-09-24" @default.
- W2034144787 title "Half‐Crystal Energy Constants" @default.
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- W2034144787 doi "https://doi.org/10.1063/1.1701039" @default.
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