A new, effective method for computing the interaction potential of hard cyclic multimer systems

• Autorzy: Bilski M.
• Języki publikacji: EN

Abstrakty

EN

Studies of effiiency of several methods for calculating the interaction potential of a pair of two-dimensional hard cyclic multimers - molecules formed by hard disks (atoms) placed at the vertices of a regular polygon - are reported in this work. Such hard-body particles, known as hard cyclic multimers, constitute a class of important reference systems in modeling structural and thermodynamic properties of molecular systems. A new method is proposed which can be easily implemented to Monte Carlo simulations of two-dimensional cyclic multimers and which is faster than the fastest method used previously.

Słowa kluczowe

EN

hard cyclic multimer; hard potential; computer simulation; Monte Carlo method

PL

twardy potencjał; symulacja komputerowa; metoda Monte Carlo

• Wydawca: Politechnika Gdańska
• Czasopismo: TASK Quarterly : scientific bulletin of Academic Computer Centre in Gdansk
• Rocznik: 2015
• Tom: Vol. 19, No 1
• Strony: 5--13
• Opis fizyczny: Bibliogr. 10 poz., rys., tab.

Twórcy

autor

Bilski M.

• Poznan University of Technology, Faculty of Technical Physics Piotrowo 3, 60-965 Poznań

Bibliografia

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• [9] Tretiakov K V 2009 Journal of Non-Crystalline Solids 355 1435
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