In this work we demonstrate the possibility of including constraints in hard systems, using the simple case of a dimer of hard spheres, where the analytical solution exists. We make a detailed description of the model and show that the system's dynamics can be solved in a rigorous way. We also illustrate our theoretical results with some numerical calculations on a simple diatomic liquid.
Simulation of a diatomic liquid using hard spheres model / Ciccotti, Giovanni; Kalibaeva, GALINA MUKSUMOVNA. - In: JOURNAL OF STATISTICAL PHYSICS. - ISSN 0022-4715. - 115:(2004), pp. 701-714. [10.1023/B:JOSS.0000019823.05483.ae]
Simulation of a diatomic liquid using hard spheres model
CICCOTTI, Giovanni;KALIBAEVA, GALINA MUKSUMOVNA
2004
Abstract
In this work we demonstrate the possibility of including constraints in hard systems, using the simple case of a dimer of hard spheres, where the analytical solution exists. We make a detailed description of the model and show that the system's dynamics can be solved in a rigorous way. We also illustrate our theoretical results with some numerical calculations on a simple diatomic liquid.File allegati a questo prodotto
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