82 citations · 83 across the 2 of their papers we have counts for
2 papers
cond-mat.mtrl-sci2014★ 82 cited
First-Principles Approach for Energy Level Alignment at Aqueous Semiconductor Interfaces
Neerav Kharche, James T. Muckerman, Mark S. Hybertsen
A first-principles approach is demonstrated to calculate the relationship between aqueous semiconductor interface structure and energy level alignment. The physical interface struc…
cond-mat.mtrl-sci2006★ 1 cited
Electronic Structure of ZnO nanowire
Xiao Shen, Mark R. Pederson, Jin-Cheng Zheng +3
This paper presents two first-principles calculations on the lattice- and electronic- structures of a small-diameter infinite and truncated ZnO nanowire. The two calculations show…