国家/地区 India（3） China（2）
关键词 DENSITY FUNCTIONAL CALCULATION（7）
出版物 APPLIED SURFACE SCI.（2） CHEMISTRYA EUROPEAN.（2） CHEMPHYSCHEM（2）
出版时间 2019（7）
机构
作者

Cycloaddition of Nitrile Oxides to Graphene: a Theoretical and Experimental Approach

CHEMISTRYA EUROPEAN JOURNAL

UCETA H, VIZUETE M, CARRILLO JR, BARREJON M, FIERRO JLG, PRIETO MP, LANGA F

ZnO Quantum Dots Coupled with Graphene toward Electrocatalytic N-2 Reduction: Experimental and DFT Investigations

CHEMISTRYA EUROPEAN JOURNAL

LIU YP, LI YB, HUANG DJ, ZHANG H, CHU K

Single-Atom Catalysis Using Chromium Embedded in Divacant Graphene for Conversion of Dinitrogen to Ammonia

CHEMPHYSCHEM

RIYAZ M, GOEL N

Density Functional Theory Study of Aspirin Adsorption on BCN Sheets and their Hydrogen Evolution Reaction Activity: a Comparative Study with Graphene and Hexagonal Boron Nitride

CHEMPHYSCHEM

YADAV VK, MIR SH, SINGH JK

Interaction of gold clusters with graphene and graphene layer over Ni (111) surface: A density functional study

APPLIED SURFACE SCIENCE

RAJESH C, MAJUMDER C

Coupled cluster investigation of the interaction of beryllium, magnesium, and calcium with pyridine: Implications for the adsorption on nitrogen-doped graphene

COMPUTATIONAL THEORETICAL CHEMISTRY

ULLAH S, DENIS PA, SATO F

The adsorption, diffusion and capacity of lithium on novel boron-doped graphene nanoribbon: A density functional theory study

APPLIED SURFACE SCIENCE

LIU HL, DONG HL, JI YJ, WANG L, HOU TJ, LI YY