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@ARTICLE{Conte:201307,
author = {Conte, A. Mosca and Violante, C. and Missori, M. and
Bechstedt, F. and Teodonio, L. and Ippoliti, E. and Carloni,
P. and Guidoni, L. and Pulci, O.},
title = {{T}heoretical optical spectroscopy of complex systems},
journal = {Journal of electron spectroscopy and related phenomena},
volume = {189 S},
issn = {0368-2048},
address = {New York, NY [u.a.]},
publisher = {Elsevier},
reportid = {FZJ-2015-03612},
pages = {46 - 55},
year = {2013},
abstract = {We review here some of the most reliable and efficient
computational theoretical ab initio techniques for the
prediction of optical and electronic spectroscopic
properties and show some important applications to
molecules, surfaces, and solids. We investigate the role of
the solvent in the optical absorption spectrum of indole
molecule. We study the excited-state properties of a
photo-active minimal model molecule for the retinal of
rhodopsin, responsible for vision mechanism in animals. We
then show a study about spectroscopic properties of Si(1 1
1) surface. Finally we simulate a bulk system: paper, that
is mainly made of cellulose, a pseudo-crystalline material
representing $40\%$ of annual biomass production in the
Earth.},
cin = {GRS / IAS-5},
ddc = {620},
cid = {I:(DE-Juel1)GRS-20100316 / I:(DE-Juel1)IAS-5-20120330},
pnm = {899 - ohne Topic (POF2-899)},
pid = {G:(DE-HGF)POF2-899},
typ = {PUB:(DE-HGF)16 / PUB:(DE-HGF)36},
UT = {WOS:000329018500009},
doi = {10.1016/j.elspec.2013.02.002},
url = {https://juser.fz-juelich.de/record/201307},
}