2 papers
cond-mat.mtrl-sci2019
Quantitative Predictions of Photoelectron Spectra in Amorphous Molecular Solids from Multiscale Quasiparticle Embedding
Gianluca Tirimbo, Xander de Vries, Christ H. L. Weijtens +3
We present a first-principles-based multiscale simulation framework for quantitative predictions of the high-energy part of the Ultraviolet Photoelectron Spectroscopy (UPS) spectra…
physics.comp-ph2005
Interrelation of work function and surface stability: the case of BaAl4
M. A. Uijttewaal, G. A. de Wijs, R. A. de Groot +3
The relationship between the work function (Phi) and the surface stability of compounds is, to our knowledge, unknown, but very important for applications such as organic light-emi…