| Title |
Published |
SHARCNET Authors |
Area |
|
2041.
Insights into the Chemical Nature of Zinc Dialkyldithiophosphate Anti-Wear Additives in their Isomeric and Decomposed Forms from Molecular Simulation
|
2004 |
N.J. Mosey, T.K. Woo
|
Computational Chemistry
|
|
2042.
Adsorption Modes of CO on CeO2 Surfaces from First Principles Calculations
|
2004 |
Z. Yang, T.K. Woo, K. Hermansson
|
Computational Chemistry
|
|
2043.
Mechanism for the formation of gas-phase protonated alcohol-ether aducts by VUV laser ionization and density-functional calculations
|
2004 |
S. Lam, Y.J. Shi, N.J. Mosey, T.K. Woo, R.H. Lipson
|
Computational Chemistry
|
|
2044.
Atomic and Electronic Structure of Unreduced and Reduced CeO2 Surfaces: A First-principles Study
|
2004 |
Z. Yang, T.K. Woo, M. Baudin, K. Hermansson
|
Computational Chemistry
|
|
2045.
A Quantum Chemical Study of the Unimolecular Decomposition Mechanisms of Zinc Dialkyldithiophosphate Anti-wear additives
|
2004 |
N.J. Mosey, T.K. Woo
|
Computational Chemistry
|
|
2046.
Mapping molecular models to continuum theories for partially miscible fluids
|
2004 |
C. Denniston
|
Condensed Matter Physics
|
|
2047.
Computer simulations of forced stretching of proteins
|
2004 |
A. Lemak, J.R. Lepock, J.Z.Y. Chen
|
|
|
2048.
Structral conversion in proteins due to mutation
|
2004 |
H. Imamura and J.Z.Y. Chen
|
|
|
2049.
Raman scattering of complex sodium aluminum hydride for hydrogen storage
|
2004 |
Daniel J. Ross, Mathew D. Halls, Abbas G. Nazri, Ricardo F. Aroca
|
Condensed Matter Physics
|
|
2050.
Compact Support Radial Basis Functions for Soft Tissue Deformation
|
2004 |
Mark P. Wachowiak, Xiaogang Wang, Aaron Fenster, Terry M. Peters
|
Image Processing Biophysics
|
|
2051.
Structure, electronic density of states and electric field gradients of icosahedral AlCuFe: An ab initio study of the original and a modified Cockayne model
|
2004 |
E.S. Zijlstra, J. Kortus, M. Krajci, Z.M. Stadnik, S.K. Bose
|
Condensed Matter Physics
|
|
2052.
Atomic structure, Electronic States, and Stability of Icosahedral Quasicrystals
|
2004 |
E. S. Zijlstra and S. K. Bose
|
Condensed Matter Physics
|
|
2053.
Quantum creep and quantum creep transitions in 1D sine-Gordan chains
|
2004 |
Florian R. Krajewski, Martin H. Müser
|
Molecular Simulation
|
|
2054.
A spectroscopic and computer simulation study of butanol vapors
|
2003 |
G. S. Fanourgakis, Y. J. Shi, S. Consta, and R. H. Lipson
|
Molecular Simulation
|
|
2055.
Neural engineering: Representation, computation, and dynamics in neurobiological systems
|
2003 |
C Eliasmith, CH Anderson
|
Computational Neuroscience
|
|
2056.
Creating three pentacoordinate carbons in a six-membered ring. An AIM and ELF study on the trishomocyclopropenyl cation and phosphorus, sulfur, arsenic, and selenium analogues.
|
2003 |
N. H. Werstiuk and Y-G. Wang
|
Computational Chemistry
|
|
2057.
An ab Initio and AIM study on the molecualr structure and stability of small CuxSy- clusters.
|
2003 |
B. Ni, J. R. Kramer, and N. H. Werstiuk
|
Computational Chemistry
|
|
2058.
Local time for processes indexed by a partially ordered set
|
2003 |
B.G. Ivanoff, P. Sawyer
|
Mathematics
|
|
2059.
The product formula for the spherical functions on symmetric spaces of noncompact type
|
2003 |
P. Graczyk, P. Sawyer
|
Mathematics
|
|
2060.
Some convexity results for the Cartan decomposition
|
2003 |
P. Graczyk, P. Sawyer
|
Mathematics
|
