papers
Publications (9)
physics.optics2017
Giant Gating Tunability of Optical Refractive Index in Transition Metal Dichalcogenide Monolayers
Yiling Yu, Yifei Yu, Lujun Huang +3
cond-mat.mtrl-sci2016
More-Realistic Band Gaps from Meta-Generalized Gradient Approximations: Only in a Generalized Kohn-Sham Scheme
Zeng-hui Yang, Haowei Peng, Jianwei Sun +1
cond-mat.mtrl-sci2017
Understanding Band Gaps of Solids in Generalized Kohn-Sham Theory
John P. Perdew, Weitao Yang, Kieron Burke +11
physics.chem-ph2016
Near-locality of exchange and correlation density functionals for 1- and 2-electron systems
Jianwei Sun, John P. Perdew, Zenghui Yang +1
cond-mat.mtrl-sci2019
Re-thinking CO adsorption on transition-metal surfaces: Density-driven error?
Abhirup Patra, Haowei Peng, Jianwei Sun +1
cond-mat.mtrl-sci2015
SCAN: An Efficient Density Functional Yielding Accurate Structures and Energies of Diversely-Bonded Materials
Jianwei Sun, Richard C. Remsing, Yubo Zhang +9
cond-mat.mtrl-sci2016
SCAN+rVV10: A promising van der Waals density functional
Haowei Peng, Zeng-Hui Yang, Jianwei Sun +1
cond-mat.mtrl-sci2016
Rehabilitation of PBE-GGA for Layered Materials
Haowei Peng, John P. Perdew
cond-mat.mtrl-sci2016
Pathway to oxide photovoltaics via band-structure engineering of SnO
Haowei Peng, Andre Bikowski, Andriy Zakutayev +1