Todd D. Beaudet, Michele Casula, Jeongnim Kim, Sandro Sorella, and Richard M. Martin, “Molecular hydrogen adsorbed on benzene: Insights from a quantum Monte Carlo study”, Journal of Chemical Physics129, 164711 (2008) http://dx.doi.org/10.1063/1.2987716
D. M. Ceperley, “Path Integrals and Supersolids”, Computer Physics Communications, 307-14 (2008) (eds. W. Janke, A. Pelster, World Scientific)
Clark, B. K. and D. M. Ceperley, “Path Integral Calculations of Vacancies in Solid Helium”, Computer Physics Communications179, 82-8 (2008)
S. Kibey, H. Sehitoglu, and D. D. Johnson, “Energy landscape for martensitic phase transformation in shape memory NiTi”, Acta Materialia57 (5), 1624-9 (2008) http://dx.doi.org/10.1016/j.actamat.2008.12.008
J. Kim, D.V. Melnikov and J.P. Leburton, “Tunable many-body effects in triple quantum dot”, Physical Review B (in press 2008)
B. Kraczek, D. D. Johnson, R. B. Haber, “A spacetime, balance-law formulation of coupled atomistic and continuum dynamics for solids” (2008) (Submitted not published)
Y. Liu, Karin A. Dahmen, and A. Berger, “The role of dipolar interactions for the determination of intrinsic switching field distributions”, Applied Physics Letters92, 222503 (2008) http://dx.doi.org/10.1063/1.2938695
Y. Liu, Karin A. Dahmen, and A. Berger, “Intrinsic switching field distribution in perpendicular recording media: numerical study of the DeltaH(M, DeltaM) method”, Physical Review B77 (54422) (2008)
Y. Liu, Karin A. Dahmen, and A. Berger, “Comparative Study of the DeltaH(M, DeltaM) method reliability for square and triangular lattices”, Journal of Applied Physics103 (07F504) (2008) (published)http://dx.doi.org/0.1063/1.2828810
D.V. Melnikov, T. Fijisawa, D.G. Austing, S. Tarucha and J.P. Leburton, “Many-body excitations in the tunneling current spectra of a few-electron quantum dots”, Physical Review B77, 165340 (2008) http://dx.doi.org/10.1103/PhysRevB.77.165340
S. T. Miller, R. B. Haber, “A spacetime discontinuous Galerkin method for hyperbolic heat conduction” (2008) (Submitted not published)
Andrew Missel and Karin A. Dahmen, “Hopping Conduction and Bacteria: Transport in Disordered Reaction Diffusion Systems”, Physical Review Letters100 (58301) (2008) http://dx.doi.org/10.1103/PhysRevLett.100.058301
J. Palaniappan, S. T. Miller, R. B. Haber, “Sub-cell shock capturing and spacetime discontinuity tracking for nonlinear conservation laws”, International Journal for Numerical Methods in Fluids (accepted 2008)
Ivan S. Ufimtsev and Todd J. Martinez, “Quantum Chemistry on Graphical Processing Units. 1. Strategies for Two-Electron Integral Evaluation”, Journal of Chemical Theory and Computation (2008) Abstracthttp://dx.doi.org/10.1021/ct700268q
I. S. Ufimtsev and T. J. Martinez, “Graphical Processing Units for Quantum Chemistry”, Computing in Science and Engineering10 (6), 26 (2008)
L-L. Wang and D.D. Johnson, “Electrocatalytic Properties of PtBi and PtPb Line Compounds via DFT: CO and H adsorption”, Journal of Physical Chemistry C (112), 8266 (2008) http://dx.doi.org/10.1021/jp7110956
J. Xu and A. W. Huebler, “Detecting quasiperiodic structures with double diffraction”, Europhysics Letters81, 16002 (in press 2008) http://dx.doi.org/10.1209/0295-5075/81/16002
N.A. Zarkevich, Teck L. Tan, L-L. Wang and D.D. Johnson, “Low-energy antiphase boundaries, degenerate superstructures, and phase stability in frustrated Ising model and Ag-Au alloys”, Physical Review B (77), 144208 (2008) http://dx.doi.org/10.1103/PhysRevB.77.144208
L.-X. Zhang, D. V. Melnikov, and J.-P. Leburton, “The von Neumann-Wigner theorem in quantum dot molecules”, Physical Review B78, 85310 (2008) (Also in the September 1, 2008 issue of Virtual Journal of Nanoscale Science and Technology)http://dx.doi.org/10.1103/PhysRevB.78.085310
L-X Zhang, D.V Melnikov, S. Agrawal and J.P. Leburton, “Size effects in the exchange coupling between two electrons in quantum wire quantum dots”, Physical Review B78, 35418 (2008) (Also in the July 21 issue of Virtual Journal of Nanoscale Science and Technology)http://dx.doi.org/10.1103/PhysRevB.78.035418
Patents
Jean-Pierre Leburton, Jeanlex Soares De Sousa,Gil De Aquino Farias, Valder Nogueira Freire, “Memory Device” (2008) (Co-patent-author was an MCC-supported visitor)Abstract
Press coverage
“Game consoles reveal their hidden power”, New Scientist (2008) (Covers computational chemistry work of Todd Martinez and two students)
Theses
Andrew Royce Missel, “Noisy Transport in Reaction-diffusion Systems with Quenched Disorder” (2008) (Advisor: Karin Dahmen)PDF
