First-principles calculations of the phase stability of TiO 2

@inproceedings{Muscat2002FirstprinciplesCO,
  title={First-principles calculations of the phase stability of TiO 2},
  author={Joseph Muscat and Varghese Swamy and Nicholas M. Harrison},
  year={2002}
}
CSIRO Minerals, Box 312, Clayton South, Victoria 3169, Australia CRCT, Ecole Polytechnique de Montreal, C.P. 6079, succursale Centre-Ville, Montreal, Quebec H3C 3A7, Canada CCLRC Daresbury Laboratory, Daresbury, Warrington, WA4 4AD, United Kingdom and Department of Chemistry, Imperial College of Science and Technology, London, SW7 2AY, United Kingdom ~Received 4 January 2002; revised manuscript received 28 March 2002; published 11 June 2002 ! 
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The DL-Visualise Software package ͑http

G Searle
The DL-Visualise Software package ͑http • 2001

47 http://www.dl.ac.uk/TCS/Software/CRYSTAL/͑The CRYSTAL Basis set library

47 http://www.dl.ac.uk/TCS/Software/CRYSTAL/͑The CRYSTAL Basis set library • 1998

145 ͑1994͒. 13 V. Milman, Properties of Complex Inorganic Solids ͑Plenum Press

M Causà, A Zupan
145 ͑1994͒. 13 V. Milman, Properties of Complex Inorganic Solids ͑Plenum Press • 1997

The Surface Science of Metal Oxides ͑Cambridge University Press

E Henrich, A F Cox
The Surface Science of Metal Oxides ͑Cambridge University Press • 1993

Electronic Structure of Solids 1991 ͑Akademie Verlag

P Perdew
J. Chem. Phys • 1991
View 1 Excerpt

Inorganic Crystal Structures ͑Wiley

G Hyde, S Andersson
Inorganic Crystal Structures ͑Wiley • 1989

Hartree-Fock Ab Initio Treatment of Crystalline Systems ͑Springer-Verlag

D Pack, H J Monkhorst, C Pisani, R Dovesi, C Roetti
Phys. Rev. B • 1748

173 ͑1989͒. 4 New Sci

L Haller, D E Resasco
173 ͑1989͒. 4 New Sci

ACS Symp. Ser

P Perdew, K Burke, M Ernzerhof
ACS Symp. Ser

Acta Crystallogr., Sect. B: Struct. Sci

J Howard, T M Sabine, F Dickson
Acta Crystallogr., Sect. B: Struct. Sci

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