Modeling Diffusion in Metal-Organic Frameworks Using On-the-fly Probability Enhanced Sampling-Based Machine Learning Potentials.
Sign Up to like & getrecommendations! Published in 2025 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.5c01191
Abstract: Machine learning potentials (MLPs) can help bridge the length- and time-scale gaps required to study diverse physicochemical phenomena in nanoporous materials with ab initio accuracy. These MLPs are typically trained on quantum chemical data obtained… read more here.
Keywords: using fly; machine learning; fly probability; learning potentials ... See more keywords
Study on Using Fly Ash for Fly Ash - Soil Piles in Reinforcing Soft Ground
Sign Up to like & getrecommendations! Published in 2020 at "Civil Engineering and Architecture"
DOI: 10.13189/cea.2020.080534
Abstract: Currently, the construction technology on soft ground reinforcement is very developed, including the technology of constructing soil-cement piles for soft soil reinforcement which is technically and economically effective and widely used. Another technology is using… read more here.
Keywords: ground; using fly; soil; soft ground ... See more keywords