国家/地区 China（16）
关键词 DENSITY FUNCTIONAL THEORY（16）
出版物 INTERNATIONAL JOURNAL OF HYDROGEN ENERGY（16）
出版时间 2015（3） 2018（3） 2016（2）
机构 HOHAI UNIV（2） UNIV SCI TE.（2）
作者 LUO QQ（2） TANG CM（2） YANG JL（2） ZHANG WH（2）
ZHANG X（2）

Enhancing of nitrogen reduction reaction to ammonia through CoB4-embedded graphene: Theoretical investigation

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

LIU J, LIANG TX, WANG F, LAI WS, LIU YJ

Single Pd atom and Pd dimer embedded graphene catalyzed formic acid dehydrogenation: A first-principles study

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

LUO QQ, ZHANG WH, FU CF, YANG JL

The effect of oxygen containing functional groups on the H-2 adsorption of graphene based nanomaterials: experiment and theory

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

LUO D, ZHANG XQ

Single Ru atom supported on defective graphene for water splitting: DFT and microkinetic investigation

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

GUO XY, LIU SG, HUANG SP

Transition metal atom embedded graphene for capturing CO: A first-principles study

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

WANG L, LUO QQ, ZHANG WH, YANG JL

Density functional theory calculations of hydrogen adsorption on Ti-, Zn-, Zr-, Al-, and N-doped and intrinsic graphene sheets

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

ZHANG HP, LUO XG, LIN XY, LU X, LENG Y

The structural and electronic properties of Li-doped fluorinated graphene and its application to hydrogen storage

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

LI Y, ZHAO GF, LIU CS, WANG YL, SUN JM, GU YZ, WANG YX, ZENG Z

Titanium-embedded graphene as high-capacity hydrogen-storage media

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

CHU SB, HU LB, HU XR, YANG MK, DENG JB

Li-decorated porous graphene as a high-performance hydrogen storage material: A first-principles study

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

WANG FD, ZHANG T, HOU XY, ZHANG WQ, TANG SW, SUN H, ZHANG JP

Electric field induced enhancement of hydrogen storage capacity for Li atom decorated graphene with Stone-Wales defects

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

ZHANG X, TANG CM, JIANG QG