国家/地区 China（4） Australia（3）
关键词 DENSITY FUNCTIONAL THEORY（11）
出版物 CHEMICAL PHYSICS（11）
出版时间 2014（2） 2022（2） 2023（2）
机构
作者 KARTON A（2）

Magnetic and optical properties of perovskite-graphene nanocomposites LaFeO3-rGO: Experimental and DFT calculations

CHEMICAL PHYSICS

ABDELAAL SK, ALY AE, CHANDUVI HHM, REBAZA AVG, ATTEIA E, SHANKAR A

DFT study of formaldehyde adsorption on vacancy defected graphene doped with B, N, and S

CHEMICAL PHYSICS

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

Theoretical investigation on carrier mobilities of armchair graphene nanoribbons with substituted edges

CHEMICAL PHYSICS

WANG G, GE HY

Adsorption of epoxy and hydroxyl groups on zigzag graphene nanoribbons: Insights from density functional calculations

CHEMICAL PHYSICS

TANG SB, ZHANG SY

Quantum dynamics study of the Langmuir-Hinshelwood H+H recombination mechanism and H-2 formation on a graphene model surface

CHEMICAL PHYSICS

KERKENI B, CLARY DC

Reversible hydrogen adsorption on Co/N-4 cluster embedded in graphene: The role of charge manipulation

CHEMICAL PHYSICS

OMIDVAR A

Hexagonal boron nitride and graphene in-plane heterostructures: An experimentally feasible approach to charge-induced switchable CO2 capture

CHEMICAL PHYSICS

TAN X, TAHINI HA, SMITH SC

Catalytic oxidation mechanism of CO on FeN2-doped graphene

CHEMICAL PHYSICS

LIU ML, LIU C, PEERA SG, LIANG TX

Adsorption of atomic and molecular monolayers on Pt-supported graphene

CHEMICAL PHYSICS

STACHOVA M, DUBECKY M, KARLICKY F

Planarization of negatively curved [7]circulene on a graphene monolayer

CHEMICAL PHYSICS

KARTON A