Soft-x-ray photoemission spectroscopy and ab initio studies on the adsorption of NO2 molecules on defective multiwalled carbon nanotubes
Author(s) -
L. Lozzi,
Silvia Picozzi,
I. Armentano,
Luca Valentini,
J. M. Kenny,
S. La Rosa,
Marcello Coreno,
Monica de Simone,
B. Delley,
S. Santucci
Publication year - 2005
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.1947768
Subject(s) - ab initio , carbon nanotube , density functional theory , adsorption , fermi level , molecule , valence (chemistry) , materials science , spectral line , density of states , photoemission spectroscopy , x ray photoelectron spectroscopy , ab initio quantum chemistry methods , electronic structure , optical properties of carbon nanotubes , molecular physics , atomic physics , chemistry , nanotube , computational chemistry , nanotechnology , condensed matter physics , physics , nuclear magnetic resonance , electron , organic chemistry , quantum mechanics , astronomy
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