国家/地区 China（6）
关键词 FIRSTPRINCIPLE（6）
出版物 APPLIED SURFACE SCI.（2） PHYSICA ELOWDIMENSI.（2）
出版时间 2017（4） 2018（2）
机构 HARBIN INST TECHNOL（6）
作者 SHUAI Y（6）

Manipulation of inherent characteristics of graphene through N and Mg atom co-doping; a DFT study

PHYSICS LETTERS A

RAFIQUE M, MIRJAT NH, SOOMRO AM, KHOKHAR S, SHUAI Y

First-principles study on silicon atom doped monolayer graphene

PHYSICA ELOWDIMENSIONAL SYSTEMS NANOSTRUCTURES

RAFIQUE M, SHUAI Y, HUSSAIN N

Theoretical perspective on structural, electronic and magnetic properties of 3d metal tetraoxide clusters embedded into single and di-vacancy graphene

APPLIED SURFACE SCIENCE

RAFIQUE M, SHUAI Y, TAN HP, MUHAMMAD H

Structural, electronic, and magnetic behaviors of 5d transition metal atom substituted divacancy graphene: A first-principles study

CHINESE PHYSICS B

MUHAMMAD R, SHUAI Y, TAN HP, MUHAMMAD H

First-principles study on hydrogen adsorption on nitrogen doped graphene

PHYSICA ELOWDIMENSIONAL SYSTEMS NANOSTRUCTURES

MUHAMMAD R, SHUAI Y, TAN HP

Structural, electronic and magnetic properties of 3d metal trioxide clusters-doped monolayer graphene: A first-principles study

APPLIED SURFACE SCIENCE

RAFIQUE M, SHUAI Y, TAN HP, HASSAN M