Session B6: Theoretical and Computational Studies of Water

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Abstracts
Sponsoring Units: DCOMP
Chair: Giulia Galli/LLNL
LACC - 502A


Monday, March 21, 2005
11:15AM - 11:51AM

B6.00001: X-ray Absorption Spectroscopy and Electronic Structure Calculations of Water and Ice
Invited Speaker: Lars G.M. Pettersson

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Monday, March 21, 2005
11:51AM - 12:27PM

B6.00002: Super-cooled and glassy water and liquid-liquid phase transitions: a computer simulation perspective
Invited Speaker: Francesco Sciortino

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Monday, March 21, 2005
12:27PM - 1:03PM

B6.00003: Ab-initio simulations of liquid water: dielectric and hydrophobic effects
Invited Speaker: Roberto Car

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Monday, March 21, 2005
1:03PM - 1:39PM

B6.00004: Structural and dynamical properties of water under ambient and high-pressure conditions
Invited Speaker: Eric Schwegler

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Monday, March 21, 2005
1:39PM - 2:15PM

B6.00005: Proton Solvation and Transport in Aqueous Environments
Invited Speaker: Gregory Voth

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