# ideal gas constant

Lennard-Jones Fluid Properties » The purpose of these pages is to provide some explicit results from molecular dynamics and Monte Carlo simul Nist.gov

Lennard-Jones Potential » The Lennard-Jones Potential is a mathematical model that explains interactions between two atoms at a certain distance. It consists of two terms that describe attractive and repulsive force between … Chem.libretexts.org

Influence of the Lennard-Jones Combination Rules on the Simulated Properties of Organic Liquids at Optimal Force-Field Parametrization » We recently introduced the CombiFF scheme [Oliveira et al., J. Chem. Theory Comput. 2020, 16, 7525], an approach for the automated refinement of force-field parameters against experimental condensed-phase data for large compound families. Using this scheme,… Ncbi.nlm.nih.gov

Lennard-Jones Potential: Prediction of gas properties » The Lennard-Jones potential describes the interaction between typically two noble gas non-bonded and uncharged atoms by intermolecular forces. (known as the van der Waals interaction). Linkedin.com

A Spectroscopic Validation of the Improved Lennard–Jones Model » The Lennard–Jones (LJ) and Improved Lennard–Jones (ILJ) potential models have been deeply tested on the most accurate CCSD(T)/CBS electronic energies calculated for some weakly bound prototype systems. These results are important to plan… Ncbi.nlm.nih.gov