Nicholas Lubbers

Less is more: Sampling chemical space with active learning

Justin S. Smith, Benjamin Nebgen, Nicholas Lubbers et al. · The Journal of Chemical Physics · 2018 · 846 citations · Full text

Computing, Chemistry, Computer Science +17

Approaching coupled cluster accuracy with a general-purpose neural network potential through transfer learning

Justin S. Smith, Benjamin Nebgen, R.I. Zubatyuk et al. · Nature Communications · 2019 · 655 citations · Full text

Natural Sciences, Chemistry, Materials Science +17

The effective field theory of dark matter direct detection

A. Liam Fitzpatrick, W. C. Haxton, Emanuel Katz et al. · Journal of Cosmology and Astroparticle Physics · 2013 · 591 citations · Full text

Natural Sciences, Physics, Nuclear Physics +14

The ANI-1ccx and ANI-1x data sets, coupled-cluster and density functional theory properties for molecules

Justin S. Smith, R.I. Zubatyuk, Benjamin Nebgen et al. · Scientific Data · 2020 · 275 citations · Full text

Natural Sciences, Chemistry, Computational Chemistry +16

Discovering a Transferable Charge Assignment Model Using Machine Learning

Andrew E. Sifain, Nicholas Lubbers, Benjamin Nebgen et al. · The Journal of Physical Chemistry Letters · 2018 · 143 citations · Full text

Natural Sciences, Chemistry, Computer Science +14