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Publications
Proceedings
CCPS 17th Annual International Conference and Workshop Risk, Reliability, and Security
General Submissions
TECHNICAL PAPERS
Selective Catalytic Reduction (SCR) System Design and Operations: Quantitative Risk Analysis of Options
2005 Annual Meeting
Session: Recent Advances in Molecular Simulation III
Presentations
08:00 AM
(475a) A Unified Methodological Framework for the Simulation of Non-Isothermal Ensembles
08:16 AM
(475b) Automatic Differentiation for Molecular Simulation
08:32 AM
(475c) Improving Free Energy Calculations: Staging Sampling and Fail-Safe Bias Detection
08:48 AM
(475d) Detailed Balance and Markov Chain Monte Carlo Simulation with Sequential Updating
09:04 AM
(475e) A Molecular Design Approach to Peptide Stabilization
09:20 AM
(475f) Molecular Simulation of the Thermophysical Properties of Fluids: Phase Behavior and Transport Properties
09:36 AM
(475g) Rheological and Structural Studies of Liquid Decane, Hexadecane, and Tetracosane under Planar Elongational Flow Using Nonequilibrium Molecular Dynamics Simulations
09:52 AM
(475h) Structure and Electronic Properties of Acene-Functionalized Polyhedral Oligomeric Silsesquioxanes (Poss) Molecules
10:08 AM
(475i) First-Principles Studies of the Electronic Properties of Hfo2 on Sic
