Agenda for High Throughput Analysis of Multicomponent
Multiphase Diffusion Data
Thursday, March 27, 2003
8:00 Coffee and
Bagels
8:30-9:00 Introduction
(Boettinger, NIST)
Modify agenda by consensus
9:00-9:30 Review of
Multicomponent Diffusion (Campbell, NIST)
-
Definitions: Tracer, Instrinic, Chemical (Interdiffusion) and Data Sources
- Types of diffusion experiments
- Methods to extract diffusion
coefficients (for a review of some of
the methods
see Bouchet and Mevrel, Acta Mat. 50 (2002) 4887)
9:30-11:00 Summary
of Availabe Software Tools for
Calculating Concentration Profiles
9:30 Profiler- Morral,
U Conn.
9:45 DICTRA Liu, Penn State
10:00 NIST Multiphase, Boettinger,
NIST
10:15 Other work summary
10:30-11:00 Computer
demonstrations
11:00-11:30 Discussion: Evaluation of current approaches:
What are the limits of the
Darken approach?
11:30-12:00 High
Throughput approach to Thermodynamics, Zi-Kui Liu, Penn State
12:00-1:00 Lunch NIST Cafeteria
1:00-1:30
MultiDiflux, Dayananda, Purdue
1:30-3:00 Discussion of Inverse Methods for
Determining Interdiffusion Coefficients from Multicomponent Data
3:00-4:00 Detailed Description of DICTRA and DICTRA format
Database
(Campbell, and Boettinger)
Description
of DICTRA, Diffusion Data format and Assessment, Examples
4:00-5:00 Computer
Demonstrations
6:30 Dinner: Sir
Walter Raleigh Inn
Friday, March 28,
2003
8:00-9:00 Discussion on development of a web site, file
sharing, teaching tools
Teaching
Inverse Diffusion Methods
9:00-10:00 DICTRA operation issues: Grid resolution etc.,
10:00-11:00 Computer time for small discussions/demos
11:00-12:00 Action Items
Lunch/Finish
|