2 citations · 2 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2023
The Role of Reference Points in Machine-Learned Atomistic Simulation Models
Xiangyun Lei, Weike Ye, Joseph Montoya +3
This paper introduces the Chemical Environment Modeling Theory (CEMT), a novel, generalized framework designed to overcome the limitations inherent in traditional atom-centered Mac…
cs.CE2023★ 2 cited
Bridging scales with Machine Learning: From first principles statistical mechanics to continuum phase field computations to study order disorder transitions in LixCoO2
G. H. Teichert, S. Das, M. Faghih Shojaei +5
LixTMO2 (TM=Ni, Co, Mn) forms an important family of cathode materials for Li-ion batteries, whose performance is strongly governed by Li composition-dependent crystal structure an…