国家/地区 India（5） Iran（4） China（3）
关键词 DFT STUDY（15）
出版物 APPLIED SURFACE SCI.（4）
出版时间 2021（5） 2020（4） 2023（3） 2022（2）
机构
作者 JAGGI N（2） RASHIDI A（2） SINGLA M（2）

Dissolved gas analysis in transformer oil using Sb-doped graphene: A DFT study

APPLIED SURFACE SCIENCE

GUI XX, ZHOU Q, PENG SD, XU LN, ZENG W

A comprehensive study of various amine-functionalized graphene oxides for room temperature formaldehyde gas detection: Experimental and theoretical approaches

APPLIED SURFACE SCIENCE

SONG MG, CHOI J, JEONG H, SONG K, JEON S, CHA J, BAECK SH, SHIM SE, QIAN Y

DFT study on Hg-0 adsorption over graphene oxide decorated by transition metals (Zn, Cu and Ni)

APPLIED SURFACE SCIENCE

ZHANG YL, ZHAO YC, YANG YJ, LIU PF, LIU J, ZHANG JY

The role of exfoliating solvents for control synthesis of few-layer graphene-like nanosheets in energy storage applications: Theoretical and experimental investigation

APPLIED SURFACE SCIENCE

PURKAIT T, AHAMMED R, DE SARKAR A, DEY RS

Adsorptive mercaptan removal of liquid phase using nanoporous graphene: Equilibrium, kinetic study and DFT calculations

ECOTOXICOLOGY ENVIRONMENTAL SAFETY

MESHKAT SS, TAVAKOLI O, RASHIDI A, ESRAFILI MD

Mechanistic insights into NO-H-2 reaction over Pt/boron-doped graphene catalyst

JOURNAL OF HAZARDOUS MATERIALS

YAO ZH, LI L, LIU XG, HUI KN, SHI L, ZHOU FR, HU MC, HUI KS

Ab-initio characterization of iron-embedded nitrogen-doped graphene as a toxic gas sensor

JOURNAL OF COMPUTATIONAL ELECTRONICS

NOSHEEN U, JALIL A, ILYAS SZ, AHMED S, ILLAHI A, RAFIQ MA

DFT study on the sensitivity of silver-graphene quantum dots for vital and harmful analytes

JOURNAL OF PHYSICS CHEMISTRY OF SOLIDS

JADOON T, MAHMOOD T, AYUB K

Experimental and DFT studies on corrosion protection performance of epoxy/graphene quantum dots@TiO2 nanotubes coatings

CONSTRUCTION BUILDING MATERIALS

JI XH, SEIF A, DUAN JZ, RASHIDI A, ZHOU ZY, POURHASHEM S, MIRZAEE M, ZHAI XF, ZHAO X, HOU BR

A Computational Study on the Some Small Graphene-Like Nanostructures as the Anodes in Na-Ion Batteries

IRANIAN JOURNAL OF CHEMISTRY CHEMICAL ENGINEERINGINTERNATIONAL ENGLISH EDITION

ALIPOUR FM, BABAZADEH M, VESSALLY E, HOSSEINIAN A, NEZHAD PDK