A mechanistic study of low-dosage inhibitors of clathrate hydrate formation
UNSPECIFIED (2001) A mechanistic study of low-dosage inhibitors of clathrate hydrate formation. In: 1st International Conference on Molecular Modeling and Simulation, JUL 23-28, 2000, KEYSTONE, CO.Full text not available from this repository.
In this paper we present results from a combined theoretical and experimental study of low dosage inhibitors (LDIs) for hydrate formation. Molecular dynamics and Monte Carlo simulations have been used to develop a detailed analysis of the structural changes that occur on the molecular level when inhibitors are added to a hydrate interface. The results are compared with experimental measurements of the LDI activity, performed as part of this study. The combination of molecular modelling and experimental probes is shown to give valuable insight into the mechanisms of inhibition.
|Item Type:||Conference Item (UNSPECIFIED)|
|Subjects:||T Technology > TP Chemical technology|
|Series Name:||AICHE SYMPOSIUM SERIES|
|Journal or Publication Title:||FOUNDATIONS OF MOLECULAR MODELING AND SIMULATION|
|Publisher:||AMER INST CHEMICAL ENGINEERS|
|Editor:||Cummings, PT and Westmoreland, PR|
|Number of Pages:||4|
|Page Range:||pp. 256-259|
|Title of Event:||1st International Conference on Molecular Modeling and Simulation|
|Location of Event:||KEYSTONE, CO|
|Date(s) of Event:||JUL 23-28, 2000|
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