5 citations · 9 across the 2 of their papers we have counts for
3 papers
cond-mat.other2022
Ab initio electronic stationary states for nuclear projectiles in solids
Jessica F. K. Halliday, Marjan Famili, Nicolo Forcellini +1
The process by which a nuclear projectile is decelerated by the electrons of the condensed matter it traverses is currently being studied by following the explicit dynamics of proj…
physics.comp-ph2021★ 5 cited
Numerical integration of quantum time evolution in a curved manifold
Jessica F. K. Halliday, Emilio Artacho
The numerical integration of the Schrödinger equation by discretization of time is explored for the curved manifolds arising from finite representations based on evolving basis sta…
cond-mat.other2021★ 4 cited
Manifold curvature and Ehrenfest forces with a moving basis
Jessica F. K. Halliday, Emilio Artacho
Known force terms arising in the Ehrenfest dynamics of quantum electrons and classical nuclei, due to a moving basis set for the former, can be understood in terms of the curvature…