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EFFECTIVE HAMILTONIANS FOR THE PREDICTION OF 
Participants Mark Asta, SandiaLaurent Bellaiche, Arkansas Ben Burton, NIST Gerd Ceder, MIT Eric Cockayne, NIST Alessio Filippetti, UCSB Karin Rabe, Rutgers David Singh, NRL Wallace Smith, ONR Anton Van der Ven, MIT
Objective The objective of this working group is to develop a unified effective Hamiltonian method for predicting phase transitions, phase equilibria, and physical properties from first principles.
Workshops The first workshop was held at NIST, Gaithersburg, MD, on June 22-23, 2000.A workshop on Thermodynamic and Structural Properties of Materials will be held in Avignon, France on September 10-14, 2001. Please contact Ben Burton at [email protected] for more information.
Other sites of interest: Ferroelectric Perovskites: Morphotropic Phase Boundary page
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NIST
is an agency of the U.S. Commerce Department's Technology Administration |