کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
10349928 863719 2013 12 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
MCMC2 : A Monte Carlo code for multiply-charged clusters
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی تئوریک و عملی
پیش نمایش صفحه اول مقاله
MCMC2 : A Monte Carlo code for multiply-charged clusters
چکیده انگلیسی
The running time depends on the number of Monte Carlo steps, cluster size, and type of interactions selected (e.g., polarisation turned on or off, and method used for calculating the induced dipoles). Typically a complete simulation can last from a few tens of minutes or a few hours for small clusters (N≤100, not including polarisation interactions), to one week for large clusters (N≥1000 not including polarisation interactions), and several weeks for large clusters (N≥1000) when including polarisation interactions. A restart procedure has been implemented that enables a splitting of the simulation accumulation phase.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Computer Physics Communications - Volume 184, Issue 3, March 2013, Pages 873-884
نویسندگان
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