15 citations · 20 across the 2 of their papers we have counts for
3 papers
Quantitative predictions of thermodynamic hysteresis: Temperature-dependent character of the phase transition in Pd-H
J. Magnus Rahm, Joakim Löfgren, Paul Erhart
The thermodynamics of phase transitions between phases that are size-mismatched but coherent differs from conventional stress-free thermodynamics. Most notably, in open systems suc…
A Computational Assessment of the Efficacy of Halides as Shape-Directing Agents in Nanoparticle Growth
Joakim Löfgren, J. Magnus Rahm, Joakim Brorsson +1
We report a comprehensive study of aqueous halide adsorption on nanoparticles of gold and palladium that addresses several limitations hampering the use of atomistic modeling as a…
libvdwxc: A library for exchange-correlation functionals in the vdW-DF family
Ask Hjorth Larsen, Mikael Kuisma, Joakim Löfgren +3
We present libvdwxc, a general library for evaluating the energy and potential for the family of vdW-DF exchange--correlation functionals. libvdwxc provides an efficient implementa…