国家/地区 Iran（4） India（3）
关键词 DFT（14）
出版物 STRUCTURAL CHEMISTRY（14）
出版时间 2020（3） 2023（3） 2021（2）
机构
作者 JOGENDER（2） KAKKAR R（2）

Structural and electronic properties of the adsorption molecules on Co and Fe/N-doped graphene towards the application in direct liquid fuel cell

STRUCTURAL CHEMISTRY

KARIM NA, SHAMSUL NS, ALIAS MS, KAMARUDIN SK

Adsorption of H(2)molecules on B/N-doped defected graphene sheets-a DFT study

STRUCTURAL CHEMISTRY

AKILAN R, VINNARASI S, MOHANAPRIYA S, SHANKAR R

Behavior of anchor functionalized ZnPc molecules on a graphene nanoflake near membrane cell

STRUCTURAL CHEMISTRY

PICAUD F, DUVERGER E, STAUFFER L, SONNET P

DFT computational study towards investigating Cladribine anticancer drug adsorption on the graphene and functionalized graphene

STRUCTURAL CHEMISTRY

DASTANI N, ARAB A, RAISSI H

A DFT study of H2CO and HCN adsorptions on 3d, 4d, and 5d transition metal-doped graphene nanosheets

STRUCTURAL CHEMISTRY

TABTIMSAI C, SOMTUA T, MOTONGSRI T, WANNO B

First principle study of hydrogen storage on the graphene-like aluminum nitride nanosheet

STRUCTURAL CHEMISTRY

MORADI M, NADERI N

Si-decorated graphene: a superior media for lithium-ions storage

STRUCTURAL CHEMISTRY

SHARIFI N, ARDJMAND M, AHANGARI MG, GANJI MD

Theoretical investigation for the reaction of N2O with CO catalyzed by Pt-Graphene

STRUCTURAL CHEMISTRY

TONG YC, WANG YC, WANG QY

Pyrene is not an appropriate model for miniature graphene in edge-functionalization

STRUCTURAL CHEMISTRY

AGRANAT I, POGODIN S, HIDMI T

Decontamination of chloropicrin (PS) and its analogues using graphene and modified graphene surfaces: a computational study

STRUCTURAL CHEMISTRY

JOGENDER, KAKKAR R