Pressure-induced structures of Si-doped HfO2

作者: Chris M. Fancher , Lili Zhao , Matthew Nelson , Ligang Bai , Guoyin Shen

DOI: 10.1063/1.4922717

关键词:

摘要: The effect of hydrostatic pressure on the structure Si-doped HfO2 (Si:HfO2) was studied by using a diamond anvil cell in combination with high-energy X-ray diffraction at synchrotron source. Diffraction data were measured situ during compression up to pressures 31 GPa. Si:HfO2 3, 5, and 9 at. % Si found undergo monoclinic orthorhombic transition between 7 15 GPa. Whole pattern analysis carried out nonpolar (Pbca) polar (Pca21) crystallographic models investigate symmetry observed high-pressure phase. Rietveld refinement results cannot discriminate reliable difference Pbca Pca21 structures as they nearly equally model data. dependent lattice parameters, relative volume, spontaneous strain are reported.

参考文章(28)
X. Zhang, C. K. Ong, Pressure-induced amorphization of β-cristobalite Physical Review B. ,vol. 48, pp. 6865- 6870 ,(1993) , 10.1103/PHYSREVB.48.6865
J. E. Lowther, J. K. Dewhurst, J. M. Leger, J. Haines, Relative stability of ZrO 2 and HfO 2 structural phases Physical Review B. ,vol. 60, pp. 14485- 14488 ,(1999) , 10.1103/PHYSREVB.60.14485
T. S. Böscke, J. Müller, D. Bräuhaus, U. Schröder, U. Böttger, Ferroelectricity in hafnium oxide thin films Applied Physics Letters. ,vol. 99, pp. 102903- ,(2011) , 10.1063/1.3634052
Lili Zhao, Matthew Nelson, Henry Aldridge, Thanakorn Iamsasri, Chris M. Fancher, Jennifer S. Forrester, Toshikazu Nishida, Saeed Moghaddam, Jacob L. Jones, Crystal structure of Si-doped HfO2 Journal of Applied Physics. ,vol. 115, pp. 034104- ,(2014) , 10.1063/1.4861733
Yahya Al-Khatatbeh, Kanani K. M. Lee, Boris Kiefer, Phase diagram up to 105 GPa and mechanical strength of HfO 2 Physical Review B. ,vol. 82, pp. 144106- ,(2010) , 10.1103/PHYSREVB.82.144106
A. P. Hammersley, S. O. Svensson, M. Hanfland, A. N. Fitch, D. Hausermann, Two-dimensional detector software: From real detector to idealised image or two-theta scan High Pressure Research. ,vol. 14, pp. 235- 248 ,(1996) , 10.1080/08957959608201408
T. S. Böscke, St. Teichert, D. Bräuhaus, J. Müller, U. Schröder, U. Böttger, T. Mikolajick, Phase transitions in ferroelectric silicon doped hafnium oxide Applied Physics Letters. ,vol. 99, pp. 112904- ,(2011) , 10.1063/1.3636434
Sebastian E. Reyes-Lillo, Kevin F. Garrity, Karin M. Rabe, Antiferroelectricity in thin-film ZrO2 from first principles Physical Review B. ,vol. 90, pp. 140103- ,(2014) , 10.1103/PHYSREVB.90.140103
H. K. Mao, J. Xu, P. M. Bell, Calibration of the ruby pressure gauge to 800 kbar under quasi-hydrostatic conditions Journal of Geophysical Research. ,vol. 91, pp. 4673- 4676 ,(1986) , 10.1029/JB091IB05P04673
Serge Desgreniers, Ken Lagarec, High-density ZrO 2 and HfO 2 : Crystalline structures and equations of state Physical Review B. ,vol. 59, pp. 8467- 8472 ,(1999) , 10.1103/PHYSREVB.59.8467