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Computer simulations of liquid/vapor interface in Lennard-Jones fluids: Some questions and answers
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14

augustus 2024

2024/2025

A+
I. POTENTIAL MODELS The full Lennard-Jones potential, ULJ(r), is given by ULJr4 r 12 r 6 , 1 where and are related to the diameter of LJ atoms and the strength of the interparticle interaction, respectively. The majority of reported MC simulations on the liquid/vapor interface are done for spherically truncated ST potential USTrULJrRr ULJr, rR 0, rR , 2 while most MD simulations are developed for the spherically truncated force F...
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