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  Crystal structure and the Mott-Hubbard gap in YTiO3 at high pressure

Loa, I., Wang, X., Syassen, K., Roth, H., Lorenz, T., Hanfland, M., et al. (2007). Crystal structure and the Mott-Hubbard gap in YTiO3 at high pressure. Journal of Physics: Condensed Matter, 19(40): 406223.

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 Creators:
Loa, I.1, Author           
Wang, X.2, Author           
Syassen, K.1, 3, Author           
Roth, H., Author
Lorenz, T., Author
Hanfland, M., Author
Mathis, Y. L., Author
Affiliations:
1Former Scientific Facilities, Max Planck Institute for Solid State Research, Max Planck Society, ou_3370501              
2Scientific Facility Crystal Growth (Masahiko Isobe), Max Planck Institute for Solid State Research, Max Planck Society, ou_3370496              
3Department Solid State Quantum Electronics (Jochen Mannhart), Max Planck Institute for Solid State Research, Max Planck Society, ou_3370485              

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 Abstract: The crystal structure of YTiO3 at high pressures up to 30 GPa has been investigated by means of synchrotron x- ray powder diffraction ( T = 295 K). The variation of the Ti - O bond lengths with pressure evidences a distinct change in the distortion of the TiO6 octahedra at around 10 GPa, which is discussed in terms of a pressure- driven spatial reorientation of the occupied Ti 3d( t(2g)) orbitals. Mid- infrared synchrotron microspectroscopy has been used to determine quantitatively the pressure- induced reduction of the optical bandgap of YTiO3, and the results are interpreted on the basis of the structural and possible orbital orientation changes.

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Language(s): eng - English
 Dates: 2007
 Publication Status: Issued
 Pages: -
 Publishing info: -
 Table of Contents: -
 Rev. Type: Peer
 Identifiers: eDoc: 338823
ISI: 000249865600025
 Degree: -

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Title: Journal of Physics: Condensed Matter
Source Genre: Journal
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Pages: - Volume / Issue: 19 (40) Sequence Number: 406223 Start / End Page: - Identifier: ISSN: 0953-8984