% IMPORTANT: The following is UTF-8 encoded. This means that in the presence
% of non-ASCII characters, it will not work with BibTeX 0.99 or older.
% Instead, you should use an up-to-date BibTeX implementation like “bibtex8” or
% “biber”.
@ARTICLE{Bonzel:59090,
author = {Bonzel, H. P. and Yu, D. K. and Scheffler, M.},
title = {{T}he three-dimensional equilibrium crystal shape of {P}b:
{R}ecent results of theory and experiment},
journal = {Applied physics / A},
volume = {87},
issn = {0947-8396},
address = {Berlin},
publisher = {Springer},
reportid = {PreJuSER-59090},
pages = {391 - 397},
year = {2007},
note = {Record converted from VDB: 12.11.2012},
abstract = {The three-dimensional equilibrium crystal shape (ECS) is
constructed from a set of 35 orientation-dependent surface
energies of fcc Pb which are calculated by density
functional theory in the local-density approximation and
distributed over the [110] and [001] zones of the
stereographic triangle. Surface relaxation has a pronounced
influence on the equilibrium shape. The (111), (100), (110),
(211), (221), (411), (665), (15,1,1), (410) and (320) facets
are present after relaxation of all considered surfaces,
while only the low-index facets (111), (100) and (110) exist
for the unrelaxed ECS. The result for the relaxed Pb crystal
state is in support of the experimental ECS of Pb at 320-350
K. On the other hand, approximating the surface energies of
vicinal surfaces by assuming a linear relationship between
the Pb(111) first-principles surface energy and the number
of broken bonds of surface atoms leads to a trivial ECS that
shows only (111) and (100) facets, with a sixfold symmetric
(111) facet instead of the correct threefold symmetry. It is
concluded that the broken bond rule in this simple linear
form is not a suitable approximation for obtaining the
proper three-dimensional ECS and correct step formation
energies.},
keywords = {J (WoSType)},
cin = {IBN-3 / CNI / JARA-FIT},
ddc = {530},
cid = {I:(DE-Juel1)VDB801 / I:(DE-Juel1)VDB381 /
$I:(DE-82)080009_20140620$},
pnm = {Grundlagen für zukünftige Informationstechnologien},
pid = {G:(DE-Juel1)FUEK412},
shelfmark = {Materials Science, Multidisciplinary / Physics, Applied},
typ = {PUB:(DE-HGF)16},
UT = {WOS:000244950900008},
doi = {10.1007/s00339-007-3951-7},
url = {https://juser.fz-juelich.de/record/59090},
}