Steven R. Gwaltney

Advances in molecular quantum chemistry contained in the Q-Chem 4 program package

Yihan Shao, Zhengting Gan, Evgeny Epifanovsky et al. · Molecular Physics · 2014 · 3.1K citations

Program Package, Engineering, Theoretical Inorganic Chemistry +22

Q-Chem 2.0: a high-performanceab initio electronic structure program package

Jing Kong, Christopher A. White, Anna I. Krylov et al. · Journal of Computational Chemistry · 2000 · 628 citations

Engineering, Computational Chemistry, Chemistry +16

Ground-state correlation energies for atomic ions with 3 to 18 electrons

Subhas J. Chakravorty, Steven R. Gwaltney, Ernest R. Davidson et al. · Physical Review A · 1993 · 524 citations

Engineering, Nuclear Physics, Computational Chemistry +16

A thermodynamic analysis of hydrogen production by steam reforming of glycerol

Sushil Adhikari, Sandun Fernando, Steven R. Gwaltney et al. · International Journal of Hydrogen Energy · 2007 · 313 citations

Chemical Engineering, Thermodynamic Analysis, Hydrogen Production +8

Second-order perturbation corrections to singles and doubles coupled-cluster methods: General theory and application to the valence optimized doubles model

Steven R. Gwaltney, C. David Sherrill, Martin Head‐Gordon et al. · The Journal of Chemical Physics · 2000 · 166 citations · Full text

Numerical Analysis, Engineering, Theoretical Inorganic Chemistry +19