| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5385258 | Chemical Physics Letters | 2010 | 6 Pages |
Abstract
⺠G4 level of theory has been applied to evaluate thermochemistry of various reactions of 5-hydroxymethylfurfural. ⺠Detailed energetics of conversion of 5-hydroxymethylfurfural to nonane. ⺠Effect of temperature and pressure on the free energy of hydrogenation and oxidation reactions of 5-hydroxymethylfurfural.
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Authors
Rajeev S. Assary, Paul C. Redfern, Jeff R. Hammond, Jeffrey Greeley, Larry A. Curtiss,