Matthew L. Leininger

Psi4: an open‐source <i>ab initio</i> electronic structure program

Justin M. Turney, Andrew C. Simmonett, Robert M. Parrish et al. · Wiley Interdisciplinary Reviews Computational Molecular Science · 2011 · 1K citations

Engineering, Physics, Computational Approaches +15

Anchoring the water dimer potential energy surface with explicitly correlated computations and focal point analyses

Gregory S. Tschumper, Matthew L. Leininger, Brian C. Hoffman et al. · The Journal of Chemical Physics · 2002 · 283 citations

Engineering, Hydrogeophysics, Computational Chemistry +21

PSI3: An open‐source <i>Ab Initio</i> electronic structure package

T. Daniel Crawford, C. David Sherrill, Edward F. Valeev et al. · Journal of Computational Chemistry · 2007 · 275 citations · Full text

Electron Affinities of the DNA and RNA Bases

Steven S. Wesolowski, Matthew L. Leininger, Plamen N. Pentchev et al. · Journal of the American Chemical Society · 2001 · 236 citations

The Design, Deployment, and Evaluation of the CORAL Pre-Exascale Systems

Sudharshan S. Vazhkudai, Bronis R. de Supinski, Arthur S Buddy Bland et al. · 2018 · 164 citations · Full text

Cluster Computing, Engineering, Coral Ecosystems +21