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Pressure-induced hydrogen bond symmetrization in iron oxyhydroxide

Xu, Weiming M. (author)
School of Physics and Astronomy, Tel Aviv University, Tel Aviv, Israel
Greenberg, Eran (author)
Bayerisches Geoinstitut, Universität Bayreuth, Bayreuth, Germany
Rozenberg, Gregory Kh. (author)
School of Physics and Astronomy, Tel Aviv University, Tel Aviv, Israel
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Pasternak, Moshe P. (author)
School of Physics and Astronomy, Tel Aviv University, Tel Aviv, Israel
Bykova, Elena (author)
Bayerisches Geoinstitut, University of Bayreuth, Bayreuth, Germany
Boffa-Ballaran, Tiziana (author)
Bayerisches Geoinstitut, University of Bayreuth, Bayreuth, Germany
Dubrovinsky, Leonid (author)
Bayerisches Geoinstitut, Universität Bayreuth, Bayreuth, Germany
Prakapenka, Vitali (author)
Consortium for Advanced Radiation Sources, University of Chicago, Argonne, USA
Hanfland, Michael (author)
European Synchrotron Radiation Facility (ESRF), Grenoble Cedex, France
Vekilova, Olga (author)
Linköpings universitet,Teoretisk Fysik,Tekniska högskolan
Simak, Sergey (author)
Linköpings universitet,Teoretisk Fysik,Tekniska högskolan
Abrikosov, Igor (author)
Linköpings universitet,Teoretisk Fysik,Tekniska högskolan
Ruffer, R. (author)
European Synchrotron Radiation Facility (ESRF), P.O. Box 220, F-38043 Grenoble, France
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 (creator_code:org_t)
2013
2013
English.
In: Physical Review Letters. - 0031-9007 .- 1079-7114. ; 111:17
Related links:
https://liu.diva-por... (primary) (Raw object)
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https://urn.kb.se/re...
https://doi.org/10.1...
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  • Journal article (peer-reviewed)
Abstract Subject headings
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  • Under high pressures the hydrogen bonds were predicted to transform from a highly asymmetric soft O-H center dot center dot center dot O to a symmetric rigid configuration in which the proton lies midway between the two oxygen atoms. Despite four decades of research on hydroxyl containing compounds, pressure induced hydrogen bond symmetrization remains elusive. Following single crystal x-ray diffraction, Mossbauer and Raman spectroscopy measurements supported by ab initio calculations, we report the H-bonds symmetrization in iron oxyhydroxide, FeOOH, resulting from the Fe3+ high-to-low spin crossover at above 45 GPa.

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TECHNOLOGY
TEKNIKVETENSKAP

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