Agenda for IFPSC session in SLC

Here is the agenda for the IFPSC session in Salt Lake City.  See you there!

Thursday, November 8, 2007: 8:30 AM-11:00 AM
M - Salon G (Marriott Salt Lake City-Downtown)

08:30
History of the IFPSC
Daniel Friend, NIST

08:35
Challenge Details and Benchmark Data
Jim Olson, Dow Chemical

08:50
(unofficial entry)
Sabyasachi Sen, Invensys

09:00
Development of the TraPPE-UA force field for Ethylene Oxide
MaryBeth H. Ketko, Jake Rafferty, J. Ilja Siepmann and Jeffrey J. Potoff
Wayne State University and University of Minnesota

09:20
Automatic tailoring of parameters for robust and broad range property
predictions by simplex optimization
Thomas Müller, Sudip Roy, Wei Zhao, Florian Müller-Plathe, Astrid
Maaß, and Dirk Reith
Tech. Univ. of Darmstadt and the Fraunhofer Inst. for Scientific
Computing and Algorithms

09:40
One Force Field for Predicting Multiple Thermodynamic Properties of
Liquid and Vapor Ethylene Oxide
XiaoFeng Li, Lifeng Zhao, Tao Cheng, Lianchi Liu, and Huai Sun
Shanghai Jiao Tong University

10:00
On the Application of Force Fields for Predicting a Wide Variety of
Properties: Ethylene Oxide as an Example
Bernhard Eckl, Jadran Vrabec, and Hans Hasse
Universitat Stuttgart

10:20
Development of a transferable all-atom force field for ethylene oxide
and its application to the calculation of 17 thermophysical properties
Jake. L. Rafferty, Neeraj Rai,  Manish S. Kelkar, J. Ilja Siepmann,
Edward J. Maginn
University of Minnesota and University of Notre Dame

10:40
Announcement of Champions
Anne Chaka, NIST

10:50
Discussion of Future Challenges
Jonathan Moore, Dow Chemical

=======================================================================
The vision of the Industrial Fluid Properties Simulation Collective is that a 
robust, accurate, and easy-to-use set of modeling tools will be widely 
available for the prediction of physical properties of fluids and obtaining 
insight into the connections between molecular structure and properties.

IFPSC webpage: http://www.fluidproperties.org/

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