88 citations · 106 across the 2 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2016
Towards rational design of carbon nitride photocatalysts: Identification of cyanamide "defects" as catalytically relevant sites
Vincent Wing-hei Lau, Igor Moudrakovski, Tiago Botari +6
The heptazine-based polymer melon (also known as graphitic carbon nitride, g-C3N4), is a promising photocatalyst for hydrogen evolution. Nonetheless, attempts to improve its inhere…
cond-mat.mtrl-sci2015★ 18 cited
Why graphene growth is very different on the C face than on the Si face of SiC: Insights from surface equilibria and the (33)-3C-SiC() reconstruction
Lydia Nemec, Florian Lazarevic, Patrick Rinke +2
We address the stability of the surface phases that occur on the C-side of 3C-SiC() at the onset of graphene formation. In this growth range, experimental…
cond-mat.mtrl-sci2007★ 88 cited
On the accuracy of first-principles lateral interactions: Oxygen at Pd(100)
Yongsheng Zhang, Volker Blum, Karsten Reuter
We employ a first-principles lattice-gas Hamiltonian (LGH) approach to determine the lateral interactions between O atoms adsorbed on the Pd(100) surface. With these interactions w…