87 citations · 171 across the 2 of their papers we have counts for
2 papers
cond-mat.stat-mech2011★ 84 cited
Exact quantum statistics for electronically nonadiabatic systems using continuous path variables
Nandini Ananth, Thomas F. Miller
We derive an exact, continuous-variable path integral (PI) representation of the canonical partition function for electronically nonadiabatic systems. Utilizing the Stock-Thoss (ST…
cond-mat.other2011★ 87 cited
Embedded density functional theory for covalently bonded and strongly interacting subsystems
Jason D. Goodpaster, Taylor A. Barnes, Thomas F. Miller
Embedded density functional theory (e-DFT) is used to describe the electronic structure of strongly interacting molecular subsystems. We present a general implementation of the Exa…