ubsuny / 23-Homework7G4

Molecular Simulation - Equilibrium Configurations of Na₄Cl₄ Tetramers: This repository contains code and analysis for a computational physics homework assignment focused on simulating and determining the equilibrium configurations of Na₄Cl₄ clusters for tetramers (n=4).
https://github.com/ubsuny/23-Homework7G4
MIT License
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Anything we could do with binding energy shown in the figure? #33

Closed s4il3sh closed 12 months ago

WildJimmy commented 12 months ago

I am also wondering this for the stranger configurations, I just brute forced it but I feel like there's a more elegant method waiting

s4il3sh commented 12 months ago

Did you make use of it? This energy also differentiates the configurations.

reshnashrestha commented 12 months ago

I have generated a function and have shown the value of binding energy in the plot.