Program overview

TUESDAY AFTERNOON, 26 AUGUST 1997

Session J1. Materials Modeling II.

Tuesday afternoon, 15:30, Room 1, Classroom Unit

15:30 J1.01 Pseudopotenial Million Atom Electronic Structure Calculations ---Application to Nanostructures
Lin-Wang Wang, Jeongnim Kim, Alex Zunger (National Renewable Energy Laboratory, Golden, CO, 80401)
15:42 J1.02 Prediction of Superconductivity in Solid C_36
Jeffrey C. Grossman, Michel Côté, Steven G. Louie, Marvin L. Cohen (Department of Physics, University of California at Berkeley, and Materials Sciences Division, Lawrence Berkeley National Laboratory)
15:54 J1.03 Simulation of spin-dependent scattering in a magnetic tunnel junction system
Ningjia Zhu, S.S.P. Parkin (IBM Research Division, Almaden Research Center, 650 Harry Road, San Jose CA 95120-6099)
16:06 J1.04 Relativistic spin - polarized theory of magnetoelastic coupling and magnetic anisotropy strain dependence: application to Co/Cu(001).
A. B. Shick, D.L. Novikov, A.J. Freeman (Northwestern U.)
16:18 J1.05 Dimer vacancies on Si(100) surface
Eunja Kim, Changfeng Chen, Tao Pang (Department of Physics, University of Nevada, Las Vegas, NV 89154, USA)
16:30 J1.06 Energetics of Topological Defects in Carbon Fullerenes, Nanocones and Nanotubes
Jie Han, Richard Jaffe (NASA Ames Research Center)
16:42 J1.07 Calculating the Linear Response Functions of Noninteracting Electrons with a Time-dependent Schroedinger Equation
T. Iitaka, S. Nomura, H. Hirayama, X.W. Zhao, Y. Aoyagi, T. Sugano (RIKEN)
16:54 J1.08 Ab Initio Study of the Structural and Electronic Properties of Solid Cubane
Steven L. Richardson (Materials Science Research Center, Howard University), José Luís Martins (University of Lisbon and INESC, Lisbon, Portugal)

Session J2. Complex Fluids, Droplets, Vortex Methods.

Tuesday afternoon, 15:30, Room 150, Stevenson

15:30 J2.01 Computation of Micro-Scale Fluid Flow with Applications to the Industrial Design of Fluid Jetting Devices
Elbridge Gerry Puckett, Igor D. Aleinov (University of California, Davis)
15:42 J2.02 POLYMER ACCUMULATION AT OIL-WATER DISPLACEMENT FRONTS
Pacelli L.J. Zitha (Delft University of Technology, Faculty of Alpplied Earth Sciences, Mijnbouwstraat 120, 2628 RX Delft, The Netherlands)
15:54 J2.03 Phase-Field Surface Tension Modeling for Two-Phase Navier-Stokes Flow
David Jacqmin (NASA Lewis Research Center)
16:06 J2.04 An Adaptive Levelset Method for Computing Solutions to Incompressible Two-Phase Flows
Mark Sussman (University of California, Davis)
16:18 J2.05 Simulating Growth and Form in an Alternating Flow
Peter M.A. Sloot, Jaap A.. Kaandorp (Faculty of Mathematics, Computer Science, Physics amp; Astronomy, University of Amsterdam Kruislaan 403 1098 SJ Amsterdam The Netherlands)
16:30 J2.06 Two-Dimensional Thermal Creep Simulations
Shida Koichiro (Musashi Institute of Technology), William G. Hoover (LLNL amp; UCDavis/Livermore)
16:42 J2.07 On the development of a three-dimensional hybrid vortex method for flow around a bluff body
Chi-Tzung Wang, Chien-Cheng Chang (Institute of Applied Mechanics, National Taiwan University, Taipei 10764, Taiwan, Republic of China)
J2.08 MODELING DYNAMIC SNAP-OFF OF OIL DROPLETS
Pacelli L.J. Zitha (Delft University of Technology, Faculty of Applied Earth Sciences, Mijnbouwstraat 120, 2628 RX Delft, The Netherlands), Peter-Jan Weijermans (Shell Research BV, Volmerlaan 8, 2280 AB Rijswijk, The Netherlands)

Session J3. Monte Carlo II.

Tuesday afternoon, 15:30, Room 2, Classroom Unit

15:30 J3.01 Quantum Monte Carlo Studies of Phase Transitions in Adsorbed Monolayers
Peter Nielaba (Institut für Theoretische Physik, Universität des Saarlandes, Postfach 151150, D-66041 Saarbrücken, Germany)
16:06 J3.02 Circumventing the pathological behavior of path-integral Monte Carlo for systems with Coulomb potentials
Martin H. Müser, Bruce J. Berne (Columbia University)
16:18 J3.03 Quantum Monte Carlo/Hartree-Fock Hybrids
Richard P. Muller, William A. Goddard (Materials and Process Simulation Center, Caltech)
16:30 J3.04 Backflow Correlation in the Three Dimensional Electron Gas
Yongkyung Kwon (Kon-Kuk Univ., Seoul 143-701, KOREA)
16:42 J3.05 Diffusion Monte Carlo Simulation of Rotations of Rigid Molecules
Parhat Niyaz, K. Birgitta Whaley (University of California, Berkeley)
16:54 J3.06 Oxidation of Cyclopentadiene by Quantum Monte Carlo Methods
Jeffrey C. Grossman (Department of Physics, University of California at Berkeley), William A. Lester Jr. (Department of Chemistry, University of California at Berkeley)

Session J4. Particle & Astrophysics.

Tuesday afternoon, 15:30, Room 175, Stevenson

15:30 J4.01 Isomultiplet Mass Splittings of Hadrons and a Suggestion from Tsukuba Group's Lattice Monte Carlo Results.
Hiroshi Katsumori (Chubu University (Retired))
15:42 J4.02 Faster fermionic Monte Carlo
Philippe de Forcrand (ETH Z"urich, Switzerland)
15:54 J4.03 QCD with improved Wilson dynamical fermions: preliminary results from UKQCD
Zbigniew Sroczynski (UKQCD Collaboration)
16:06 J4.04 Modeling of spatial distribution of galaxies in alternative Milne's cosmology.
Simon Berkovich (GWU)
16:18 J4.05 Numerical Hydrodynamic Models of Neutron Star Mergers
F. Douglas Swesty (University of Illinois), Edward Wang (Washington University of St. Louis)
16:30 J4.06 Multi-dimensional, Multi-group Radiation Hydrodynamic Models of Convection in Supernovae
F. Douglas Swesty (University of Illinois)
16:42 J4.07 The Sudbury Neutrino Observatory Data Acquisition System
Qazi Ahmad, James Beck, Meijer Drees Reena, Mark Howe, John Wilkerson (University of Washington), Frank McGirt (Los Alamos National Laboratory), Yuen-dat Chan (Lawrence Berkeley Laboratory)
16:54 J4.08 Galerkin-Basis-Spline method for lattice representation of quantum many-particle systems
V.E. Oberacker, D.R. Kegley, A.S. Umar (Vanderbilt University)