2 papers
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…
cond-mat.mtrl-sci2003
Anisotropy of the Mobility of Pentacene from Frustration
Gilles A. de Wijs, Christine C. Mattheus, Robert A. de Groot +1
The bandstructure of pentacene is calculated using first-principles density functional theory. A large anisotropy of the hole and electron effective masses within the molecular pla…