Kohn symposium - program (prel.)

"Manifestation of applications of DFT in Physics and Chemistry in Northern Europe" 

June 4-5, 1999

at Hjortviken Konferens, Hindås, 30 km east of  Göteborg, Sweden

Presentations

Name Topic
Walter Kohn Electronic Structure of Matter: Wave Functions and Density Functionals
Kieron Burke Energy densities
Goran Grimvall Reconciling ab initio and semiempirical approaches to lattice energies
Kari Laasonen DFT molecular dynamics simulations of water and acid solutions
Michele Parrinello Title to be announced
Björn O. Roos DFT and electronic spectroscopy for molecules, a critical study
Elfi Kraka Applications of DFT methods to solve pending chemical problems
Juergen Graefenstein, Dieter Cremer The Combination of Multi-Reference Theory with DFT - a promising method for the future?
Hannes Jonson DFT on Ice
Matthias Scheffler Surfaces / adsorption (and/or growth)
Ole Krogh Andersen From KKR to Polynomial MTOs
Risto Nieminen Electrons and positrons in solids: two-component density-functional theory
Bjork Hammer The ambiguity of the PBE exchange- correlation expression: Improving molecular bond energies and chemisorption bond energies within the PBE construction logic
Goteborg students, postdocs et al. Parade and posters
Helsinki students, postdocs et al. Parade and posters
Uppsala students, postdocs et al. Parade and posters
Lyngby students, postdocs et al. Parade and posters
Jens K. Norskov  DFT as a basis for understanding bonding at surfaces and in enzymes
Igor Abrikosov Invar effect in fcc Fe-Ni alloys
Jari Kinaret DFT Approach to Spin Textures in the Quantum Hall Systems
Yashar Yourdshahyan DFT for metal oxides oxide ceramics
Itai Panas "Back-of-the-envelope-DFT"

Preliminary time plan
Time Activity
Friday
12.00 LUNCH
13.15 SESSION (Cairman: Lars Hedin)
Walter Kohn (45)
Björn O. Roos (30)
Elfi Kraka (20)
Juergen Graefenstein & Dieter Cremer (20)
Discussion
15.30 COFFEE
16.00 PARADE AND POSTER SESSION (Chairman: Göran Grimvall)
Yashar Yourdshahyan (10)
Göteborg (30)
Risto Nieminen (25)
Helsinki (20)
Lyngby (15)
Igor Abrikosov (15)
Uppsala (20)
Discussion
Poster show
19.30 CONFERENCE DINNER
Saturday
07.30 BREAKFAST
08.30 SESSION (Chairman: David Langreth)
Kieron Burke (25)
Bjork Hammer (30)
Itai Panas (10)
Jari Kinaret (20)
Discussion
10.30 COFFEE
11.00 SESSION (Chairman: Peter Nordlander)
Matthias Scheffler (25)
Jens K. Norskov and Karsten W. Jacobsen (30)
Discussion
12.30 POSTERS AND LUNCH
13.30 SESSION (Chairman: Mats Jonson)
Ole Krogh Andersen (20)
Göran Grimvall (20)
Hannes Jónson (25)
Kari Laasonen (25)
Michele Parrinello (25)
Discussion
15.40 CONCLUDING REMARKS (Walter Kohn)
16.00 COFFEE AND END OF SYMPOSIUM

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