Lixin Zhang

发表

The Key Role of van der Waals Interactions in MPc/Au(111) (M = Co, Fe, H2) Systems Based on First-Principles Calculations

Shaoyuan Li, Zhenpeng Hu, Jialei Hao, 2014 .

Two-dimensional van der Waals heterostructures (vdWHs) with band alignment transformation in multi-functional devices

J. Zapien, N. Shehzad, S. Saeed, 2022, RSC advances.

Structures, Scaling Relations, and Selectivities of the Copper-Based Binary Catalysts for CO2 Reduction Reactions

Yan Ding, Lixin Zhang, Yangyang Xu, 2022, The Journal of Physical Chemistry C.

Effect of Defects on Spontaneous Polarization in Pure and Doped LiNbO3: First-Principles Calculations

Y. Kong, Jingjun Xu, Jingjun Xu, 2018, Materials.

Analysis of the structure and abnormal photoluminescence of a red-emitting LiMgBO3:Mn2+ phosphor.

Y. Kong, Jingjun Xu, H. Yi, 2018, Dalton transactions.

Interaction between Mo and intrinsic or extrinsic defects of Mo doped LiNbO3 from first-principles calculations

Y. Kong, Jingjun Xu, Jingjun Xu, 2019, Journal of physics. Condensed matter : an Institute of Physics journal.

Bifunctional mechanism of N, P co-doped graphene for catalyzing oxygen reduction and evolution reactions.

E. Wang, Li-Ming Tang, Keqiu Chen, 2019, The Journal of chemical physics.

p-Type conductivity mechanism and defect structure of nitrogen-doped LiNbO3 from first-principles calculations.

Y. Kong, Jingjun Xu, Jingjun Xu, 2019, Physical chemistry chemical physics : PCCP.

Monolayer 1T and 1T' MoSO as Promising Electrocatalyst for Hydrogen Evolution based on First Principle Calculations.

Feifei Li, Z. Niu, Lixin Zhang, 2021, Chemphyschem : a European journal of chemical physics and physical chemistry.

Efficient Electrocatalysts of Single Metal Atom Supported on Defective Graphene for Oxygen Reduction Reaction (ORR): a First Principles Study

Rui Zhang, N. Shehzad, B. Amin, 2023, Chemical Physics.

Tunable Band Structures of Heterostructured Bilayers with Transition-Metal Dichalcogenide and MXene Monolayer

Qing Tang, Zhen Zhou, Dihua Wu, 2014 .

Substrate engineering in stabilizing epitaxial MgO(1 1 1) polar ultrathin films: first-principles calculations

Jingjun Xu, Zhenpeng Hu, Yexin Feng, 2014, Journal of physics. Condensed matter : an Institute of Physics journal.

The atomic structures of carbon nitride sheets for cathode oxygen reduction catalysis.

Hui-Tian Wang, Zhenpeng Hu, Mei Wang, 2013, The Journal of chemical physics.

Dimerization of boron dopant in diamond (100) epitaxy induced by strong pair correlation on the surface

E. Wang, Zhenpeng Hu, Yexin Feng, 2013, Journal of physics. Condensed matter : an Institute of Physics journal.

The vertical growth of MoS2 layers at the initial stage of CVD from first-principles.

Keqiu Chen, Yexin Feng, Xiong-Xiong Xue, 2018, The Journal of chemical physics.

Tuning the catalytic property of nitrogen-doped graphene for cathode oxygen reduction reaction

Jingjun Xu, Hui-Tian Wang, E. Wang, 2012 .

Revealing the growth mechanism of SiV centers in chemical vapor deposition of diamond

Yexin Feng, Lixin Zhang, Yu Guo, 2016 .

Hydrogen induced contrasting modes of initial nucleations of graphene on transition metal surfaces.

E. Wang, Xin-Zheng Li, Keqiu Chen, 2017, The Journal of chemical physics.

Ab initio study of the moisture stability of lead iodine perovskites

Wu-Xing Zhou, Keqiu Chen, Yexin Feng, 2018, Journal of physics. Condensed matter : an Institute of Physics journal.

Hydrogen induced contrasting modes of initial nucleations of graphene on transition metal surfaces.

E. Wang, Xin-Zheng Li, Keqiu Chen, 2017, The Journal of chemical physics.

Microscopic origin for the orientation dependence of NV centers in chemical-vapor-deposited diamond

E. Wang, Yexin Feng, Lixin Zhang, 2014, Journal of physics. Condensed matter : an Institute of Physics journal.