Publications

Author:
Year:

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"Microscopic Origin of Channeled Flow in Lamellar Titanium Aluminide"
Ivaylo H. Katzarov and Anthony T. Paxton, June 2010
doi:10.1103/physrevlett.104.225502

"Atomic-scale characterization of theSrTiO3Σ3(112)[1¯10]grain boundary"
K. J. Dudeck and N. A. Benedek and M. W. Finnis and D. J. H. Cockayne, April 2010
doi:10.1103/physrevb.81.134109

"Ab initiopotentials ofF+Li2accessible at ultracold temperatures"
K. W. A. Wright and Ian C. Lane, September 2010
doi:10.1103/physreva.82.032715

"Density-potential mapping in time-dependent density-functional theory"
N. T. Maitra and T. N. Todorov and C. Woodward and K. Burke, May 2010
doi:10.1103/physreva.81.042525

"Thermodynamic properties and atomistic structure of the dry amorphous silica surface from a reactive force field model"
Raffaela Cabriolu and Pietro Ballone, April 2010
doi:10.1103/physrevb.81.155432

"Solid-liquid interface free energy through metadynamics simulations"
Stefano Angioletti-Uberti and Michele Ceriotti and Peter D. Lee and Mike W. Finnis, March 2010
doi:10.1103/physrevb.81.125416

"Nonconservative generalized current-induced forces"
Tchavdar N. Todorov and Daniel Dundas and Eunan J. McEniry, March 2010
doi:10.1103/physrevb.81.075416

"A genetic algorithm for predicting the structures of interfaces in multicomponent systems"
Alvin L.-S. Chua and Nicole A. Benedek and Lin Chen and Mike W. Finnis and Adrian P. Sutton, March 2010
doi:10.1038/nmat2712

"Solid and liquid charge-transfer complex formation between 1-methylnaphthalene and 1-alkyl-cyanopyridinium bis(trifluoromethyl)sulfonylimide ionic liquids"
Christopher Hardacre and John D. Holbrey and Claire L. Mullan and Mark Nieuwenhuyzen and Tristan G. A. Youngs and Daniel T. Bowron and Simon J. Teat, January 2010
doi:10.1039/b921160h

"First-principles study of substitutional metal impurities in graphene: structural, electronic and magnetic properties"
E J G Santos and A Ayuela and D Sánchez-Portal, May 2010
doi:10.1088/1367-2630/12/5/053012

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