David B. Williams‐Young

The Chronus Quantum software package

David B. Williams‐Young, Alessio Petrone, Shichao Sun et al. · Wiley Interdisciplinary Reviews Computational Molecular Science · 2019 · 122 citations · Full text

An efficient implementation of two-component relativistic density functional theory with torque-free auxiliary variables

Alessio Petrone, David B. Williams‐Young, Shichao Sun et al. · The European Physical Journal B · 2018 · 62 citations

Engineering, Physics, Natural Sciences +5

Relativistic Real-Time Time-Dependent Equation-of-Motion Coupled-Cluster

Lauren N. Koulias, David B. Williams‐Young, Daniel R. Nascimento et al. · Journal of Chemical Theory and Computation · 2019 · 60 citations

Generalized Hartree–Fock with Nonperturbative Treatment of Strong Magnetic Fields: Application to Molecular Spin Phase Transitions

Shichao Sun, David B. Williams‐Young, Torin F. Stetina et al. · Journal of Chemical Theory and Computation · 2018 · 50 citations

Direct <i>ab Initio</i> (Meta-)Surface-Hopping Dynamics

David B. Lingerfelt, David B. Williams‐Young, Alessio Petrone et al. · Journal of Chemical Theory and Computation · 2016 · 47 citations

Localized Excited State, Engineering, Excitation Energy Transfer +16