国家/地区 Spain（10）
关键词
出版物 CARBON（3） PHYSICAL CHEMISTRY .（3）
出版时间 2016（2）
机构 UNIV BARCELO.（8）
作者 ILLAS F（10）

Correcting Flaws in the Assignment of Nitrogen Chemical Environments in N-Doped Graphene

JOURNAL OF PHYSICAL CHEMISTRY C

FIGUERAS M, VILLARGARCIA IJ, VINES F, SOUSA C, O SHEA VAD, ILLAS F

On the H-2 interactions with transition metal adatoms supported on graphene: a systematic density functional study

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

MANADE M, VINES F, GIL A, ILLAS F

Identifying atomic sites in N-doped pristine and defective graphene from ab initio core level binding energies

CARBON

BELLAFONT NP, MANERU DR, ILLAS F

Theoretical assessment of graphene-metal contacts

JOURNAL OF CHEMICAL PHYSICS

JANTHON P, VINES F, KOZLOV SM, LIMTRAKUL J, ILLAS F

A theoretical study of a ZnO graphene analogue: adsorption on Ag(111) and hydrogen transport

JOURNAL OF PHYSICSCONDENSED MATTER

DEMIROGLU I, STRADI D, ILLAS F, BROMLEY ST

Influence of NO and (NO)(2) adsorption on the properties of Fe-N4 porphyrin-like graphene sheets

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

ASHORI E, NAZARI F, ILLAS F

The contact of graphene with Ni(111) surface: description by modern dispersive forces approaches

THEORETICAL CHEMISTRY ACCOUNTS

MUNOZGALAN H, VINES F, GEBHARDT J, GORLING A, ILLAS F

Role of structural symmetry breaking in the structurally induced robust superlubricity of graphene and h-BN homo- and heterojunctions

CARBON

ANSARI N, NAZARI F, ILLAS F

Transition metal adatoms on graphene: A systematic density functional study

CARBON

MANADE M, VINES F, ILLAS F

Assigning XPS features in B,N-doped graphene: input from ab initio quantum chemical calculations

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

COSTA R, MORALESGARCIA A, FIGUERAS M, ILLAS F