国家/地区 China（4）
关键词
出版物 JOURNAL OF MOLECULAR MODELING（4）
出版时间 2013（4）
机构
作者

A density functional theory study on oxygen reduction reaction on nitrogen-doped graphene

JOURNAL OF MOLECULAR MODELING

ZHANG J, WANG ZJ, ZHU ZP

Influence of doped nitrogen and vacancy defects on the thermal conductivity of graphene nanoribbons

JOURNAL OF MOLECULAR MODELING

YANG HY, TANG YQ, GONG J, LIU Y, WANG XL, ZHAO YF, YANG P, WANG ST

The effects of external electric field: creating non-zero first hyperpolarizability for centrosymmetric benzene and strongly enhancing first hyperpolarizability for non-centrosymmetric edge-modified graphene ribbon H2N-(3,3)ZGNR-NO2

JOURNAL OF MOLECULAR MODELING

BAI Y, ZHOU ZJ, WANG JJ, LI Y, WU D, CHEN W, LI ZR, SUN CC

Molecular vibrational spectroscopy characterization of epoxy graphene oxide from density functional calculations

JOURNAL OF MOLECULAR MODELING

LIU B, SUN HJ, PENG TJ, JI GF