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@ARTICLE{Rushchanskii:22145,
author = {Rushchanskii, K. Z. and Lezaic, M.},
title = {{A}b initio phonon structure of h-{YM}n{O}3 in low-symmetry
ferroelectric phase},
journal = {Ferroelectrics},
volume = {426},
issn = {0015-0193},
address = {London [u.a.]},
publisher = {Taylor $\&$ Francis},
reportid = {PreJuSER-22145},
pages = {90 - 96},
year = {2012},
note = {For many fruitful discussions we thank Prof. Dr. Stanislav
Kamba and Dr. Ivetta Slipukhina. We gratefully acknowledge
the support by the Young Investigators Group Program of the
Helmholtz association (Contract VH-NG-409), as well as the
support of the Julich Supercomputer Center.},
abstract = {We present a systematic first-principles study of the
phonon spectrum of hexagonal YMnO3 in ferroelectric
(multiferroic) phase. We investigated in detail the
low-energy phonon modes, their dispersion, symmetry, as well
as the infrared optical properties of the crystal and
determined the phonon density of states.},
keywords = {J (WoSType)},
cin = {IAS-1 / PGI-1},
ddc = {530},
cid = {I:(DE-Juel1)IAS-1-20090406 / I:(DE-Juel1)PGI-1-20110106},
pnm = {Grundlagen für zukünftige Informationstechnologien},
pid = {G:(DE-Juel1)FUEK412},
shelfmark = {Materials Science, Multidisciplinary / Physics, Condensed
Matter},
typ = {PUB:(DE-HGF)16},
UT = {WOS:000304266300015},
doi = {10.1080/00150193.2012.671116},
url = {https://juser.fz-juelich.de/record/22145},
}