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- W2143175033 abstract "ABSTRACT A formalism for obtaining the zero-temperature structure of mono-component solids by simulated quenching in the grand-canonical ensemble is outlined. The structure of a high-angle twist grain boundary on the (110) plane of an fee metal is investigated. The lowest energy structure is found to have a density approximately 20% higher than the structure obtained from canonical-ensemble energy-minimization." @default.
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- W2143175033 date "1991-01-01" @default.
- W2143175033 modified "2023-09-27" @default.
- W2143175033 title "Reconstruction of a High-Angle Twist Grain Boundary by Grand-Canonical Simulated Quenching" @default.
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- W2143175033 doi "https://doi.org/10.1557/proc-238-183" @default.
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