Theoretical Study on the Factors Controlling the Stability of the Borate Complexes of Ribose, Arabinose, Lyxose and Xylose... Journal August, 2008
A Universal Model for Nanoporous Carbon Supercapacitors Applicable to Diverse Pore Regimes, Carbons, and Electrolyte Journal July, 2008
Quantum Monte Carlo algorithms for electronic structure at the petascale; the endstation project Conference Paper July, 2008
Computational Challenges of Large-Scale Long-Time First-Principles Molecular Dynamics Conference Paper July, 2008
Combined density functional and dynamical cluster quantum Monte Carlo calculations of the three-band Hubbard model for hole-doped cuprate superconductors Journal July, 2008
Equivalence of dipole correction and Coulomb cutoff techniques in supercell calculations Journal June, 2008
Short-range spin and charge correlations and local density of states in the colossal magnetoresistance regime of the single-orbital model for manganites. Journal June, 2008
