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New Journal of Physics, volume 15, issue 9, pages 93010

Evolution of the electronic structure in Mo1−xRexalloys

Michio OKADA 1
E Rotenberg 2
Stephen D. Kevan 3, 4
J. Schäfer 5
B. Újfalussy 6, 7
G.Malcolm Stocks 6
B Genatempo 8
E. Bruno 8
4
 
Department of Physics, University of Oregon, Eugene, OR 94703, USA
5
 
Physikalisches Institut, Universität Würzburg, Am Hubland, D-97074 Würzburg, Germany.
8
 
Departmento di Fisica, Univerita di Messina, Salita Sperone 31, I-98166 Messina, Italy
9
 
Department of Physics and Astronomy, Louisiana State University, Baton Rouge, LA 70803-4001, USA
Publication typeJournal Article
Publication date2013-09-05
Quartile SCImago
Q1
Quartile WOS
Q2
Impact factor3.3
ISSN13672630
General Physics and Astronomy
Abstract
We report a detailed experimental and theoretical study of the electronic structure of Mo1−xRex random alloys. We have measured electronic band dispersions for clean and hydrogen-covered Mo1−xRex(110) with x = 0–0.25 using angle-resolved photoemission spectroscopy. Our results suggest that the bulk and most surface electronic bands shift relative to the Fermi level systematically and approximately rigidly with Re concentration. We distinguish and quantify two contributions to these shifts: a raise of the Fermi energy and an increase of the overall bandwidth. Alloy bands calculated using the first-principles Korringa–Kohn–Rostoker coherent-potential-approximation method accurately predict both of these effects. As derived from the rigid band model, the Fermi energy shift is inversely related to the bulk density of states in this energy region. Using our results, we also characterize an electronic topological transition of the bulk Fermi surface and relate this to bulk transport properties. Finally, we distinguish effects beyond the rigid band approximation: a highly surface-localized state and a composition-dependent impact of the spin–orbit interaction.

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GOST |
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GOST Copy
OKADA M. et al. Evolution of the electronic structure in Mo1−xRexalloys // New Journal of Physics. 2013. Vol. 15. No. 9. p. 93010.
GOST all authors (up to 50) Copy
OKADA M., Rotenberg E., Kevan S. D., Schäfer J., Újfalussy B., Stocks G., Genatempo B., Bruno E., Zhu X. Evolution of the electronic structure in Mo1−xRexalloys // New Journal of Physics. 2013. Vol. 15. No. 9. p. 93010.
RIS |
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RIS Copy
TY - JOUR
DO - 10.1088/1367-2630/15/9/093010
UR - https://doi.org/10.1088/1367-2630/15/9/093010
TI - Evolution of the electronic structure in Mo1−xRexalloys
T2 - New Journal of Physics
AU - OKADA, Michio
AU - Rotenberg, E
AU - Kevan, Stephen D.
AU - Schäfer, J.
AU - Újfalussy, B.
AU - Stocks, G.Malcolm
AU - Genatempo, B
AU - Bruno, E.
AU - Zhu, Xuetao
PY - 2013
DA - 2013/09/05 00:00:00
PB - IOP Publishing
SP - 93010
IS - 9
VL - 15
SN - 1367-2630
ER -
BibTex |
Cite this
BibTex Copy
@article{2013_OKADA,
author = {Michio OKADA and E Rotenberg and Stephen D. Kevan and J. Schäfer and B. Újfalussy and G.Malcolm Stocks and B Genatempo and E. Bruno and Xuetao Zhu},
title = {Evolution of the electronic structure in Mo1−xRexalloys},
journal = {New Journal of Physics},
year = {2013},
volume = {15},
publisher = {IOP Publishing},
month = {sep},
url = {https://doi.org/10.1088/1367-2630/15/9/093010},
number = {9},
pages = {93010},
doi = {10.1088/1367-2630/15/9/093010}
}
MLA
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MLA Copy
OKADA, Michio, et al. “Evolution of the electronic structure in Mo1−xRexalloys.” New Journal of Physics, vol. 15, no. 9, Sep. 2013, p. 93010. https://doi.org/10.1088/1367-2630/15/9/093010.
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