NaCl

The 'NaCl' dataset/benchmark contains molecular dynamics simulation data of aqueous NaCl solutions used to evaluate the ion-specific effects on water diffusion in electrolyte solutions.

Papers using NaCl (6)

Ion-Specific Anomalous Water Diffusion in Aqueous Electrolytes: A Machine-Learned Many-Body Force Field Study with MACE2026Long-range machine-learning potentials with environment-dependent charges enable predicting LO-TO splitting and dielectric constants2026Accurate Fourth-Generation Machine Learning Potentials by Electrostatic Embedding2023 · 45 citesBest Practices for Fitting Machine Learning Interatomic Potentials for Molten Salts: A Case Study Using NaCl-MgCl22024 · 10 citesFirst-principles molten salt phase diagrams through thermodynamic integration2023 · 6 citesCapturing long-range interaction with reciprocal space neural network2022 · 4 cites