Modeling of gas hydrates from first principles
Thesis (Ph.D.)--Massachusetts Institute of Technology, Dept. of Chemical Engineering, 2002. === Includes bibliographical references. === Ab initio calculations were used to determine the H20-CH4 potential energy surface (PES) accurately for use in modeling gas hydrates. Electron correlation was foun...
| Main Author: | |
|---|---|
| Other Authors: | |
| Format: | Others |
| Language: | English |
| Published: |
Massachusetts Institute of Technology
2005
|
| Subjects: | |
| Online Access: | http://hdl.handle.net/1721.1/8496 |