Global minimum search via annealing: Nanoscale gold clusters
نویسندگان
چکیده
منابع مشابه
Search for global minimum geometries for medium sized germanium clusters: Ge12-Ge20.
We have performed an unbiased search for the global minimum geometries of small-to-medium sized germanium clusters Gen(12< or =n< or =18) as well as a biased search (using seeding method) for Gen(17< or =n< or =20). We employed the basin-hopping algorithm coupled with the plane-wave pseudopotential density functional calculations. For each size, we started the unbiased search with using several...
متن کاملSearch for global-minimum geometries of medium-sized germanium clusters. II. Motif-based low-lying clusters Ge21-Ge29.
We performed a constrained search for the geometries of low-lying neutral germanium clusters Ge(N) in the size range of 21 < or = N < or = 29. The basin-hopping global optimization method is employed for the search. The potential-energy surface is computed based on the plane-wave pseudopotential density functional theory. A new series of low-lying clusters is found on the basis of several gener...
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200. von Hippel AR (1956) Molecular engineering. Science 123(3191):315–317 201. von Neumann J (1956) Probabilistic Logics and the Synthesis of Reliable Organisms from Unreliable Components. In: Automata Studies. Princeton University Press, Princeton, pp 43–98 202. Waingold E, Taylor M, SrikrishnaD, Sarkar V, Lee W, Lee V, Kim J, Frank M, Finch P, Barua R, Babb J, Amarasinghe S, Agarwal A (1997)...
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ژورنال
عنوان ژورنال: Chemical Physics Letters
سال: 2015
ISSN: 0009-2614
DOI: 10.1016/j.cplett.2015.01.026