国家/地区 China（6） Iran（2） Russia（2）
关键词 DFT（14）
出版物 DIAMOND RELATED MATERIALS（14）
出版时间 2022（5） 2021（3） 2023（3） 2020（2）
机构 IRKUTSK NATL.（2）
作者 CHEN XP（2） PETRUSHENKO .（2） PETRUSHENKO .（2）

Theoretical insights into the performance of graphene derivatives, h-BN and BNC heterostructures in the adsorption and elimination of atrazine: An all-electron DFT study

DIAMOND RELATED MATERIALS

GOLI A, ALINEZHAD H, GANJI MD

Graphene-BN-organic nanoflake complexes: DFT, IGM and SAPT0 insights

DIAMOND RELATED MATERIALS

PETRUSHENKO IK, TIKHONOV NI, PETRUSHENKO KB

Adsorption of diatomic molecules on graphene, h-BN and their BNC heterostructures: DFT study

DIAMOND RELATED MATERIALS

PETRUSHENKO IK, PETRUSHENKO KB

Electronic and magnetic properties of stacked graphene quantum dots

DIAMOND RELATED MATERIALS

TIUTIUNNYK A, LAROZE D, CORREA JD, MORARAMOS ME

The reduced graphene oxide/WO3: Sensing properties for NO2 gas detection at room

DIAMOND RELATED MATERIALS

FELLAH MF

DFT investigation of transition metal-doped graphene for the adsorption of HCl gas

DIAMOND RELATED MATERIALS

TANG H, XIANG Y, ZHAN HH, ZHOU YH, KANG JY

Enhancing oxygen reduction reaction performance via CNTs/graphene supported iron protoporphyrin IX: A hybrid nanoarchitecture electrocatalyst

DIAMOND RELATED MATERIALS

KUMAR A, YASIN G, VASHISTHA VK, DAS DK, REHMAN MU, IQBAL R, MO ZS, NGUYEN TA, SLIMANI Y, NAZIR MT, ZHAO W

A DFT study of adsorption properties of SO2, SOF2, and SO2F2 on ZnO/CuO doped graphene

DIAMOND RELATED MATERIALS

XU P, GUI YA, CHEN XP

Structural, electronic and optical properties of AB bilayer graphene intercalated by Sr atom: A first principles study

DIAMOND RELATED MATERIALS

FARKAD O, TAKASSA R, ELFATOUAKI F, HASSINE S, IJDIYAOU Y, IBNOUELGHAZI EA, ABOUELAOUALIM D

A facile mold-free micromechanical method for patterning multilayer graphene by utilizing the difference in interfacial adhesion forces

DIAMOND RELATED MATERIALS

RAGUL S, KRISHNAN D, DUTTA S, RAY D