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Projects in Awesome Lists tagged with lennard-jones

A curated list of projects in awesome lists tagged with lennard-jones .

https://github.com/amphiluke/potprox

Approximation of computed data with empirical pair potentials

approximation buckingham lennard-jones morse potential rydberg

Last synced: 01 Oct 2024

https://github.com/vtlim/plot_potential

Plot individual potential functions that comprise force fields. Ideal for presentations. Includes energy terms for bonds (harmonic), angles (harmonic), proper torsion (periodic cosine), improper torsion (harmonic), van der Waals (Lennard-Jones), electrostatics (Coulomb), and the Morse potential.

computational-chemistry cosine coulomb-interactions energy-functions forcefield harmonic lennard-jones matplotlib molecular-dynamics molecular-modeling molecular-simulation morse potential presentation-materials vdw

Last synced: 01 Oct 2024