Session Index

Session P18: Condensed Phase Dynamics, Structure and Thermodynamics

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Abstracts
Sponsoring Units: DCP
Chair: Branka Ladanyi, Colorado State University
Room: Colorado Convention Center 103


Wednesday, March 7, 2007
11:15AM - 11:27AM

P18.00001: First-principles study of molecular point defects in ice Ih
Maurice de Koning , Alex Antonelli , Antonio J.R. da Silva , Adalberto Fazzio

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Wednesday, March 7, 2007
11:27AM - 11:39AM

P18.00002: Size- and Temperature- Dependent Crystal Growth Rates
Xian-Ming Bai , Mo Li

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Wednesday, March 7, 2007
11:39AM - 11:51AM

P18.00003: ESR Studies of a Reorienting Nickel Complex
Bruce Kowert

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Wednesday, March 7, 2007
11:51AM - 12:03PM

P18.00004: Low coverage Neon adsorption on HiPCo$^{TM}$ nanotube bundles
Subramanian Ramachandran , Oscar Vilches

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Wednesday, March 7, 2007
12:03PM - 12:15PM

P18.00005: Structure and dynamics of levitated liquid aluminates
Louis Hennet , Irina Pozdnyakova , Marie-Louise Saboungi , David L. Price

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Wednesday, March 7, 2007
12:15PM - 12:27PM

P18.00006: Thermal Fluctuations and Excitonic Interactions in Polyadenosine
John Jean

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Wednesday, March 7, 2007
12:27PM - 12:39PM

P18.00007: The activation of phosphoramide mustard anticancer drugs from ab initio simulations.
Markus Allesch , Eric Schwegler , Mike Colvin , Francois Gygi , Giulia Galli

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Wednesday, March 7, 2007
12:39PM - 12:51PM

P18.00008: Use of light scattering data to determine free energies of ternary mixtures
George Thurston , David Ross , Carl Lutzer , Seth Fraden

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Wednesday, March 7, 2007
12:51PM - 1:03PM

P18.00009: Proton momentum distributions in water: A path integral molecular dynamics study
Varadharajan Srinivasan , Joseph A. Morrone , Daniel Sebastiani , Roberto Car

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Wednesday, March 7, 2007
1:03PM - 1:15PM

P18.00010: Calculation of Proton Transfer Rates in Liquids Using Molecular Dynamics Simulations
Yin Guo

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Wednesday, March 7, 2007
1:15PM - 1:27PM

P18.00011: Local structure and the intermediate-energy fine structure in x-ray Raman scattering from ice Ih
G.T. Seidler , T.T. Fister , C. Hamner , F.D. Vila , J.O. Cross

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Wednesday, March 7, 2007
1:27PM - 1:39PM

P18.00012: Covalency in Actinide and Lanthanide Hexachloride Anions
Ping Yang , Enrique Batista , Richard Martin , Christin Carlson , David Clark , Steven Conradson , Daniel Schwarz , Marinne Wilkerson

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Wednesday, March 7, 2007
1:39PM - 1:51PM

P18.00013: Site Sensitivity and local electronic symmetries in carboranes
T.T. Fister , G.T. Seidler , F.D. Vila , J.O. Cross , J.C. Linehan

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Wednesday, March 7, 2007
1:51PM - 2:03PM

P18.00014: The electronic structure of Co and Ni tetraazaannulenes
Jing Liu , Jie Xiao , P. Jeppson , P.A. Dowben , Seok-Bong Choi , L. Jarabek , A.N. Caruso , Ya.B. Losovyj

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Wednesday, March 7, 2007
2:03PM - 2:15PM

P18.00015: Pump-Probe Photoionization Spectroscopy of penta methyl cyclopentadiene
Peter Weber , Fedor Rudakov

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