国家/地区 China（13）
关键词 REACTION MECHANISM（2）
出版物 CARBON（3） JOURNAL OF PHYSICAL.（2）
出版时间 2016（7） 2015（4）
机构 CHINESE ACAD.（9） INNER MONGOL.（3）
作者 JIAO MG（13）

A first-principles study on the role of hydrogen in early stage of graphene growth during the CH4 dissociation on Cu(111) and Ni(111) surfaces

CARBON

LI K, HE CZ, JIAO MG, WANG Y, WU ZJ

Theoretical study on the interaction of pristine, defective and strained graphene with Fe-n and Ni-n (n=13, 38, 55) clusters

CHEMICAL PHYSICS LETTERS

SONG W, JIAO MG, LI K, WANG Y, WU ZJ

Theoretical Investigation on the Reaction Pathways of the Oxygen Reduction Reaction on Graphene Codoped with Manganese and Phosphorus as a Potential Nonprecious Metal Catalyst

CHEMCATCHEM

BAI XW, ZHAO EJ, LI K, WANG Y, JIAO MG, HE F, SUN XX, YANG J, WU Z

Dual-site oxygen reduction reaction mechanism on CoN4 and CoN2 embedded graphene: Theoretical insights

CARBON

SUN XX, LI K, YIN C, WANG Y, JIAO MG, HE F, BAI XW, TANG H, WU ZJ

Theoretical insights on the reaction pathways for oxygen reduction reaction on phosphorus doped graphene

CARBON

BAI XW, ZHAO EJ, LI K, WANG Y, JIAO MG, HE F, SUN XX, SUN H, WU ZJ

Theoretical insights on the catalytic activity and mechanism for oxygen reduction reaction at Fe and P codoped graphene

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

HE F, LI K, XIE GY, WANG Y, JIAO MG, TANG H, WU ZJ

First-Principles Study on Nitrobenzene-Doped Graphene as a Metal Free Electrocatalyst for Oxygen Reduction Reaction

JOURNAL OF PHYSICAL CHEMISTRY C

JIAO MG, SONG W, LI K, WANG Y, WU ZJ

Theoretical Investigation on the Reaction Pathways for Oxygen Reduction Reaction on Silicon Doped Graphene as Potential Metal-Free Catalyst

JOURNAL OF THE ELECTROCHEMICAL SOCIETY

BAI XW, ZHAO EJ, LI K, WANG Y, JIAO MG, HE F, SUN XX, SUN H, WU ZJ

QM/MD studies on graphene growth from small islands on the Ni (111) surface

NANOSCALE

JIAO MG, SONG W, QIAN HJ, WANG Y, WU ZJ, IRLE S, MOROKUMA K

Theoretical insights on the influence of doped Ni in the early stage of graphene growth during the CH4 dissociation on Ni-Cu(111) surface

APPLIED CATALYSIS AGENERAL

HE F, LI K, XIE GY, WANG Y, JIAO MG, TANG H, WU ZJ