Fragility of the A-Type AF and CE Phases of Manganites: Insulator-To-Metal Transition Induced by Quenched Disorder Journal September, 2006
Adsorption, Desorption, and Dissociation of Benzene on TiO2(110) and Pd/TiO2(110)... Journal September, 2006
Direct computation of general chemical energy differences: Application to ionization potentials, excitation, and bond energie... Journal September, 2006
Fracture in Three-Dimensional Random Fuse Model: Recent Advances Through High-Performance Computing Conference Paper September, 2006
First-principles theory of quantum well resonance in double barrier magnetic tunnel junctions Journal August, 2006
Computational challenges in the large-scale simulations of fracture in disordered media ... Conference Paper August, 2006
