| Monday, 31 October 2005: 12:30 PM-3:00 PM | |||
| 210 (Cincinnati Convention Center) | |||
Low Pressure (01g) | |||
| #56 - Computational Modeling of Surfaces and Surface Phenomena (01G02) | |||
| This session will focus on the use of computational chemistry to model surface phenomena. | |||
| CoChair: | Aravind R. Asthagiri | ||
| Chair: | Gyeong S. Hwang | ||
| 12:30 PM | 56a | Experimental and Computational Probing of the Transition States to Surface Reactions Andrew J. Gellman, David S. Sholl, Xin Li | |
| 12:55 PM | 56b | First-Principles Studies of Amino Acid Adsorption on Chiral Mineral Surfaces Aravind R. Asthagiri, Robert M. Hazen | |
| 1:20 PM | 56c | Accelerated Molecular Dynamics Simulation of Thermal Desorption Kelly E. McLaughlin, Kristen A. Fichthorn | |
| 1:45 PM | 56d | Surface Smoothening Mechanism of Plasma-Deposited Amorphous Silicon Thin Films Mayur S. Valipa, Tamas Bakos, Eray S. Aydil, Dimitrios Maroudas | |
| 2:10 PM | 56e | A Simple Chemical View of Relaxations at (110) Surfaces of Rutile Structure-Type Oxides Thomas A. Muscenti, Gerald V. Gibbs, David F. Cox | |
| 2:35 PM | 56f | Surface Structure and Reactivity of Clean and Hydrated Α-Fe2O3 Cynthia S. Lo, Anne M. Chaka, Thomas P. Trainor | |
| Sponsor: | Engineering Sciences and Fundamentals | ||
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