国家/地区 China（3）
关键词 DENSITY FUNCTIONAL THEORY（8）
出版物 APPLIED SURFACE SCIENCE（8）
出版时间 2015（8）
机构
作者

A DFT study of electronic and magnetic properties of titanium decorating point-defective graphene

APPLIED SURFACE SCIENCE

ZHOU QX, FU ZB, WANG CY, TANG YJ, ZHANG H, YUAN L, YANG X

Adsorption of acetyl halide molecules on the surface of pristine and Al-doped graphene: Ab initio study

APPLIED SURFACE SCIENCE

RAD AS, KASHANI OR

Adsorption mechanisms of lithium oxides (LixO2) on a graphene-based electrode: A density functional theory approach

APPLIED SURFACE SCIENCE

LEE JH, KANG SG, MOON HS, PARK H, KIM IT, LEE SG

Covalent and noncovalent functionalization of pristine and defective graphene by cyclohexane and dehydrogenated derivatives

APPLIED SURFACE SCIENCE

SAYIN CS, TOFFOLI D, USTUNEL H

Adsorption of RuSex (x=1-5) cluster on Se-doped graphene: First principle calculations

APPLIED SURFACE SCIENCE

AKTURK OU, TOMAK M

A first-principles study on gas sensing properties of graphene and Pd-doped graphene

APPLIED SURFACE SCIENCE

MA L, ZHANG JM, XU KW, JI V

Electronic and vibrational properties of graphene monolayers with iron adatoms: A density functional theory study

APPLIED SURFACE SCIENCE

DIMAKIS N, NAVARRO NE, VELAZQUEZ J, SALGADO A

Adsorption properties of CoPc molecule on epitaxial graphene/Ru(0001)

APPLIED SURFACE SCIENCE

CAI YL, ZHANG HJ, SONG JJ, ZHANG YX, BAO SN, HE PM