Search

Learning to Use the Force: Fitting Repulsive Potentials in Density

$ 10.00 · 4.6 (760) · In stock

Repulsive Force –

Lennard-Jones potential - Wikipedia

Ultra-fast interpretable machine-learning potentials

Lydia NEMEC, PostDoc Position, Dr., Technische Universität München, München, TUM, Chair for Theoretical Chemistry

Numerical Optimization of Density Functional Tight Binding Models: Application to Molecules Containing Carbon, Hydrogen, Nitrogen, and Oxygen

Nanoconfined methane density over pressure and temperature: Wettability effect - ScienceDirect

Machine learning coarse-grained potentials of protein thermodynamics

PDF) Curvature Constrained Splines for DFTB Repulsive Potential Parametrization

Applied Sciences, Free Full-Text