9 citations · 9 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2021★ 9 cited
Computational catalyst discovery: Active classification through myopic multiscale sampling
Kevin Tran, Willie Neiswanger, Kirby Broderick +3
The recent boom in computational chemistry has enabled several projects aimed at discovering useful materials or catalysts. We acknowledge and address two recurring issues in the f…
cond-mat.mtrl-sci2019
Methods for comparing uncertainty quantifications for material property predictions
Kevin Tran, Willie Neiswanger, Junwoong Yoon +3
Data science and informatics tools have been proliferating recently within the computational materials science and catalysis fields. This proliferation has spurned the creation of…