30 citations · 74 across the 8 of their papers we have counts for
3 papers · 1 filter
Synergizing chemical and AI communities for advancing laboratories of the future
Saejin Oh, Xinyi Fang, I-Hsin Lin +6
The development of automated experimental facilities and the digitization of experimental data have introduced numerous opportunities to radically advance chemical laboratories. As…
Fast phase prediction of charged polymer blends by white-box machine learning surrogates
Clayton Ellis, Xinyi Fang, Christopher Balzer +4
Compatibilized polymer blends are a complex, yet versatile and widespread category of material. When the components of a binary blend are immiscible, they are typically driven towa…
Neural Operators for Forward and Inverse Potential-Density Mappings in Classical Density Functional Theory
Runtong Pan, Xinyi Fang, Kamyar Azizzadenesheli +3
Neural operators are capable of capturing nonlinear mappings between infinite-dimensional functional spaces, offering a data-driven approach to modeling complex functional relation…