Direct Prediction of Phonon Density of States With Euclidean Neural Networks
Sign Up to like & getrecommendations! Published in 2021 at "Advanced Science"
DOI: 10.1002/advs.202004214
Abstract: Abstract Machine learning has demonstrated great power in materials design, discovery, and property prediction. However, despite the success of machine learning in predicting discrete properties, challenges remain for continuous property prediction. The challenge is aggravated… read more here.
Keywords: direct prediction; phonon density; density states; prediction phonon ... See more keywords
Exploring direct prediction of surface tension from COSMO-RS theory
Sign Up to like & getrecommendations! Published in 2018 at "Chemical Physics Letters"
DOI: 10.1016/j.cplett.2018.06.036
Abstract: Abstract In this work, the potential of COSMO-RS for direct prediction of surface tension through a desolvation-based model is explored. It is shown that for most investigated molecules, the model gives reasonable approximation of the… read more here.
Keywords: direct prediction; cosmo; surface; surface tension ... See more keywords
Direct prediction of bidirectional reflectance by dense particulate deposits
Sign Up to like & getrecommendations! Published in 2019 at "Journal of Quantitative Spectroscopy and Radiative Transfer"
DOI: 10.1016/j.jqsrt.2018.12.012
Abstract: Abstract To observe and study the effects of the volume packing density on polarimetric scattering by deposited particulate materials, a comparison is made between the vector radiative transport equation (VRTE) and the plane wave plane… read more here.
Keywords: direct prediction; prediction bidirectional; bidirectional reflectance; volume ... See more keywords