60 citations · 145 across the 15 of their papers we have counts for
4 papers · 1 filter
: extensible, high-level workflows for swifter materials modeling
Qi Zhang, Chaoxuan Gu, Jingyi Zhuang +1
In this work, we introduce an open-source project, , an extensible, high-throughput, high-level workflow framework that aims to automate $\textit…
The Excited Spin State of Dimorphos Resulting from the DART Impact
Harrison F. Agrusa, Ioannis Gkolias, Kleomenis Tsiganis +12
The NASA Double Asteroid Redirection Test (DART) mission is a planetary defense-driven test of a kinetic impactor on Dimorphos, the satellite of the binary asteroid 65803 Didymos.…
Defect-Driven Anomalous Transport in Fast-Ion Conducting Solid Electrolytes
Andrey D. Poletayev, James A. Dawson, M. Saiful Islam +1
Solid-state ionic conduction is a key enabler of electrochemical energy storage and conversion. The mechanistic connections between material processing, defect chemistry, transport…
Interpretable discovery of new semiconductors with machine learning
Hitarth Choubisa, Petar Todorović, Joao M. Pina +5
Machine learning models of materials accelerate discovery compared to ab initio methods: deep learning models now reproduce density functional theory (DFT)-calculated resul…