32 citations · 32 across the 1 of their papers we have counts for
3 papers
physics.chem-ph2014
turboTDDFT 2.0 - Hybrid functionals and new algorithms within time-dependent density-functional perturbation theory
Xiaochuan Ge, Simon J. Binnie, Dario Rocca +2
We present a new release of the turboTDDFT code featuring an implementation of hybrid functionals, a recently introduced pseudo-Hermitian variant of the Liouville-Lanczos approach…
cond-mat.stat-mech2012
Symmetries of cyclic work distributions for an isolated harmonic oscillator
Ian J. Ford, David S. Minor, Simon J. Binnie
We have calculated the distribution of work done on a 1-d harmonic oscillator that is initially in canonical equilibrium at temperature , then thermally isolated and driven…
cond-mat.mtrl-sci2010★ 32 cited
Bulk and surface energetics of lithium hydride crystal: benchmarks from quantum Monte Carlo and quantum chemistry
S. J. Binnie, S. J. Nolan, N. D. Drummond +4
We show how accurate benchmark values of the surface formation energy of crystalline lithium hydride can be computed by the complementary techniques of quantum Monte Carlo (QMC) an…