Publications

Author:
Year:

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"THE OXIDATION OF NIAL: What Can We Learn from Ab Initio Calculations?"
M.W. Finnis and A.Y. Lozovoi and A. Alavi, June 2005
doi:10.1146/annurev.matsci.35.101503.091652

"Automatic generation of matrix element derivatives for tight binding models"
Alin M. Elena and Matthias Meister, October 2005
doi:10.1103/physrevb.72.165107

"Molecular effects in the ionization ofN2,O2, andF2by intense laser fields"
Daniel Dundas and Jan M. Rost, January 2005
doi:10.1103/physreva.71.013421

"Solvent-induced symmetry breaking: Varying solvent strength"
F. S. Zhang and R. M. Lynden-Bell, February 2005
doi:10.1103/physreve.71.021502

"Multiphoton double ionization of atoms and molecules by FEL XUV light"
K.T. Taylor and J.S. Parker and D. Dundas and K.J. Meharg and B.J. S. Doherty and D.S. Murphy and J.F. McCann, March 2005
doi:10.1016/j.elspec.2005.01.270

"Current-driven magnetic rearrangements in spin-polarized point contacts"
Maria Stamenova and Stefano Sanvito and Tchavdar N. Todorov, October 2005
doi:10.1103/physrevb.72.134407

"Expressions for the second-order mixed partial derivatives of Slater-Koster matrix elements at spherical coordinate singularities"
Matthias Meister, October 2005
doi:10.1103/physrevb.72.165108

"First-principles study of ferroelectricity and isotope effects in H-bondedKH2PO4crystals"
S. Koval and J. Kohanoff and J. Lasave and G. Colizzi and R. L. Migoni, May 2005
doi:10.1103/physrevb.71.184102

"Bandstructure approach to near edge structure"
A. T. Paxton and A. J. Craven and J. M. Gregg and D. W. McComb, December 2005
doi:10.1046/j.1365-2818.2003.01182.x

"Correlated electron–ion dynamics: the excitation of atomic motion by energetic electrons"
Andrew P Horsfield and D R Bowler and A J Fisher and Tchavdar N Todorov and Cristián G Sánchez, July 2005
doi:10.1088/0953-8984/17/30/006

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