Yunxia Liu, Krisztian Palotas, Xiao Yuan, Tingjun Hou, Haiping Lin*, Youyong Li*, Shuit-Tong Lee, "Atomistic origins of surface defects in CH3NH3PbBr3 perovskite and their electronic structures", ACS Nano, 2017, 11，2060-2065.
Jiawei Liu, Yujin Ji, Yuqiang Liu, Zhouhui Xia, Yujie Han, Youyong Li*, Baoquan Sun*, "Doping-free asymmetrical silicon heterocontact achieved by integrating conjugated molecules for high efficient solar cell", Adv. Ener. Mat., 2017, DOI: 10.1002/aenm.201700311.
Yujin Ji, Mingye Yang, Huilong Dong, Tingjun Hou, Lu Wang*and Youyong Li*, "Two-Dimensional Germanium Monochalcogenide Photocatalyst for Water Splitting under Ultraviolet, Visible to Near-infrared Light", Nanoscale, 2017, DOI: 10.1039/C7NR00688H. (Back Cover Story)
Yujin Ji, Mingye Yang, Huilong Dong,* Lu Wang, Tingjun Hou, Youyong Li*, "Monolayer group IVAmonochalcogenides as potential and efficient catalysts for oxygen reduction reaction from the first-principles calculations", J. Mater. Chem. A. 2017, 5, 1734 - 1741.
Xiaotian Sun, Yunxia Liu, Zhigang Song, Yongdan Li, Weizhou Wang, Haiping Lin, Lu Wang* and Youyong Li*, "Title Structures, Mobility and Electronic Properties of Point Defects in Arsenene, Antimonene and Antimony Arsenide Alloy", J. Mater. Chem. C, 2017, 5, 4159-4166. (Back Cover Story)
Mingye Yang, Lu Wang*, Tingjun Hou, Youyong Li*, "Controlling of the Electronic Properties of WS2 and Graphene Oxide Heterostructures from First-principles calculations", J. Mater. Chem. C, 2017, 5, 201.
Huilong Dong,* Lu Wang, Liujiang Zhou, Tingjun Hou, Youyong Li,* "Theoretical investigations on novel SiC5 siligraphene as gas sensor for air pollutants", Carbon, 2017, 113, 114-121.
Xiao Yuan, Mingye Yang, Lu Wang*, Youyong Li*, "Structural Stability and Intriguing Electronic Prop erties of Two-dimensional Transition Metal Dichalcogenides Alloys", Phys. Chem. Chem. Phys., 2017, Accepted.
Feng Zhou, Bin Wu, Huilong Dong, Qingfeng Xu, Jinghui He, Youyong Li, Jun Jiang, Jianmei Lu, "The application of a small-molecule-based ternary memory device in transient thermal-probing electronics", Adv. Mater., 2017. 29, 1604162.
Jianyu Yuan, Michael J. Ford, Yannan Zhang, Huilong Dong, Zhi Li, Youyong Li, Thuc-Quyen Nguyen, Guillermo C. Bazan, Wanli Ma, "Toward Thermal Stable and High Photovoltaic Efficiency Ternary Conjugated Copolymers: Influence of Backbone Fluorination and Regio-selectivity", Chemistry of Materials, 2017, 29, 1758-1768.
Xiaolin Lv, Kaiqi Nie, Huiwen Lan, Xin Li, Youyong Li, Xuhui Sun, Jun Zhong, Shuit-Tong Lee, "Fe2TiO5-incorporated hematite with surface P-modification for high efficiency solar water splitting", Nano Energy, 2017, 32, 526-532.
Wang P, fang Y, Jiang J, Ji Y, Li YY, Zheng J, Xu Q, Lu JM, "Resistance Controllability in Alkynylgold(III) Complex- based Resistive Memory for Flash-type Storage Applications", Chem Asian J. 2017, doi: 10.1002/asia.201700369.
Jing Gao, Yujin Ji, Youyong Li, Jun Zhong, Xuhui Sun, "The Morphological Effect on Electronic Structure and Electrical Transport Property of One-dimensional Carbon Nanostructures", RSC Advances, 2017, Accepted.
Tian, Sheng; Wang, Xu; Li, Linlang; Zhang, Xiaohu; Li, Youyong; Zhu, Feng; Hou, Tingjun; Zhen, Xuechu, "Discovery of Novel and Selective Adenosine A2A Receptor Antagonists for Treating Parkinson's Disease through Comparative Structure-based Virtual Screening" Journal of Chemical Information and Modeling, 2017, Accepted.
Zhixiong Zhan, Linlang Li, Sheng Tian, Xuechu Zhen Youyong Li, "Prediction of Chemical Biodegradability by Using Computational Methods" Molecular Simulation, 2017, DOI: 10.1080/08927022.2017.1328556
Fu Chen, Huiyong Sun, Hui Liu, Dan Li, Youyong Li, Tingjun Hou, "Predicition of luciferase inhibitors by high-performance MIEC-GBDT approach based on interaction energetic patterns" Phys. Chem. Chem. Phys., 2017, Accepted.
Hualin Ye, Lu Wang, Shuo Deng, Xiaoqiao Zeng, Kaiqi Nie, Paul N. Duchesne, Bo Wang, Simon Liu, Junhua Zhou, Feipeng Zhao, Na Han, Peng Zhang, Jun Zhong, Xuhui Sun, Youyong Li, Yanguang Li and Jun Lu, “Amorphous MoS3 Infiltrated with Carbon Nanotubes as an Advanced Anode Material of Sodium-Ion Batteries with Large Gravimetric, Areal and Volumetric Capacitites”. Adv. Energy. Mater. DOI: 10.1002/aenm.201601602.