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@ARTICLE{Akola:44011,
author = {Akola, J. and Rytkönen, K. and Manninen, M.},
title = {{M}etallic evolution of small magnesium clusters},
journal = {The European physical journal / D},
volume = {16},
issn = {1434-6060},
address = {Berlin},
publisher = {Springer},
reportid = {PreJuSER-44011},
pages = {21},
year = {2001},
note = {Record converted from VDB: 12.11.2012},
abstract = {Structural and electronic properties of small magnesium
clusters (N less than or equal to 13) are studied using a
first-principles simulation method in conjunction with the
density functional theory and generalized gradient
correction approximation for the exchange-correlation energy
functional. It is observed that the onset of metallization
of magnesium clusters is hard to assign since both the s-p
hybridization and the energy gap between the valence and
conduction bands do not evolve rapidly towards the known
bulk properties. Instead these quantities show a slow and
nonmonotonic evolution.},
keywords = {J (WoSType)},
cin = {IFF-TH-I},
ddc = {530},
cid = {I:(DE-Juel1)VDB30},
pnm = {Elektronische Struktur von Festkörpern, Oberflächen und
Schichtsystemen},
pid = {G:(DE-Juel1)FUEK52},
shelfmark = {Optics / Physics, Atomic, Molecular $\&$ Chemical},
typ = {PUB:(DE-HGF)16},
UT = {WOS:000172039400005},
doi = {10.1007/s100530170051},
url = {https://juser.fz-juelich.de/record/44011},
}