341 citations · 456 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2019★ 341 cited
FCHL revisited: faster and more accurate quantum machine learning
Anders S. Christensen, Lars A. Bratholm, Felix A. Faber +1
We introduce the FCHL19 representation for atomic environments in molecules or condensed-phase systems. Machine learning models based on FCHL19 are able to yield predictions of ato…
physics.chem-ph2018★ 115 cited
Operators in Machine Learning: Response Properties in Chemical Space
Anders S. Christensen, Felix A. Faber, O. Anatole von Lilienfeld
The role of response operators is well established in quantum mechanics. We investigate their use for universal quantum machine learning models of response properties in molecules.…