most citedRevealing the molecular structures of a-Al2O3(0001)-water interface by machine learning based computational vibrational spectroscopy

28 citations · 29 across the 4 of their papers we have counts for

collaborators
Showing physics.chem-phShow all

1 paper · 1 filter

physics.chem-ph2026

3D Molecular Representation Learning for Organic Mixtures: Viscosity and Density Prediction

Haicheng Qu, Yanyi Su, Ning Wang +4

The viscosity and density of organic mixtures are essential properties for designing lubricants, solvents, and heat transfer fluids. In engineering practice, formulating a function…