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@ARTICLE{Aguilera:896713,
author = {Aguilera, Irene and Kim, Hyun-Jung and Friedrich, Christoph
and Bihlmayer, Gustav and Blügel, Stefan},
title = {{Z} 2 topology of bismuth},
journal = {Physical review materials},
volume = {5},
number = {9},
issn = {2475-9953},
address = {College Park, MD},
publisher = {APS},
reportid = {FZJ-2021-03546},
pages = {L091201},
year = {2021},
abstract = {While first-principles calculations with different levels
of sophistication predict a topologically trivial Z2 state
for bulk bismuth, some photoemission experiments show
surface states consistent with the interpretation of bismuth
being in a topologically nontrivial Z2 state. We resolve
this contradiction between theory and experiment by showing,
based on quasiparticle self-consistent GW calculations, that
the experimental surface states interpreted as supporting a
nontrivial phase are actually consistent with a trivial Z2
invariant. We identify this contradiction as the result of a
crosstalk effect arising from the extreme penetration depth
of the surface states into the bulk of Bi. A film of Bi can
be considered bulklike only for thicknesses of about 1000
bilayers (≈400 nm) and more.},
cin = {IAS-1 / PGI-1 / JARA-FIT / JARA-HPC / IEK-5},
ddc = {530},
cid = {I:(DE-Juel1)IAS-1-20090406 / I:(DE-Juel1)PGI-1-20110106 /
$I:(DE-82)080009_20140620$ / $I:(DE-82)080012_20140620$ /
I:(DE-Juel1)IEK-5-20101013},
pnm = {5211 - Topological Matter (POF4-521)},
pid = {G:(DE-HGF)POF4-5211},
typ = {PUB:(DE-HGF)16},
UT = {WOS:000705548700005},
doi = {10.1103/PhysRevMaterials.5.L091201},
url = {https://juser.fz-juelich.de/record/896713},
}