国家/地区 China（5） Uruguay（2）
关键词 DENSITY FUNCTIONAL CALCULATION（12）
出版物 CHEMPHYSCHEM（4） CHEMISTRYA EUROPEAN.（2）
出版时间 2013（12）
机构 CHINESE ACAD.（2） UDELAR（2）
作者 DENIS PA（2）

Nickel Cluster Growth on Defect Sites of Graphene: A Computational Study

ANGEWANDTE CHEMIEINTERNATIONAL EDITION

GAO W, MUELLER JE, ANTON J, JIANG Q, JACOB T

Adsorption of sulfuric acid on graphene with a high titanium coverage and on the [001] titanium surface

SURFACE SCIENCE

CARRILLO I, RANGEL E, RAMIREZDEARELLANO JM, MAGANA LF

Organic Chemistry of Graphene: The Diels-Alder Reaction

CHEMISTRYA EUROPEAN JOURNAL

DENIS PA

Structural and Magnetic Properties of 3d Transition-Metal-Atom Adsorption on Perfect and Defective Graphene: A Density Functional Theory Study

CHEMPHYSCHEM

ZHANG TT, ZHU LY, YUAN SJ, WANG JL

On the Addition of Aryl Radicals to Graphene: The Importance of Nonbonded Interactions

CHEMPHYSCHEM

DENIS PA

First-Principles Study of Boron- and Nitrogen-Doped Graphene in the Presence of Point Surface Defects

JOURNAL OF COMPUTATIONAL THEORETICAL NANOSCIENCE

TARAWNEH K, ALAQTASH N

Modulation of charge transport properties of reduced graphene oxide by submonolayer physisorption of an organic dye

ORGANIC ELECTRONICS

PATHIPATI SR, PAVLICA E, TREOSSI E, RIZZOLI R, VERONESE GP, PALERMO V, CHEN L, BELJONNE D, CAI JM, FASEL R, RUFFIEUX P, BRATINA G

Computational Studies on Non-covalent Interactions of Carbon and Boron Fullerenes with Graphene

CHEMPHYSCHEM

MANNA AK, PATI SK

In Situ Synthesis and Nonvolatile Rewritable-Memory Effect of Polyaniline-Functionalized Graphene Oxide

CHEMISTRYA EUROPEAN JOURNAL

ZHANG B, CHEN Y, REN YJ, XU LQ, LIU G, KANG ET, WANG C, ZHU CX, NEOH KG

An Effective Approach to Achieve a Spin Gapless SemiconductorHalf-MetalMetal Transition in Zigzag Graphene Nanoribbons: Attaching A Floating Induced Dipole Field via Interactions

ADVANCED FUNCTIONAL MATERIALS

GUAN J, CHEN W, LI YF, YU GT, SHI ZM, HUANG XR, SUN CC, CHEN ZF