Vibrational properties of levulinic acid and furan derivatives: Raman spectroscopy and theoretical calculations
- Authors:
- Publication Date:
- Research Org.:
- Energy Frontier Research Centers (EFRC) (United States). Institute for Atom-efficient Chemical Transformations (IACT)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- OSTI Identifier:
- 1380910
- DOE Contract Number:
- AC02-06CH11357
- Resource Type:
- Journal Article
- Journal Name:
- Journal of Raman Spectroscopy
- Additional Journal Information:
- Journal Volume: 42; Journal Issue: 12; Related Information: IACT partners with Argonne National Laboratory (lead); Brookhaven National Laboratory; Northwestern University; Purdue University; University of Wisconsin at Madison; Journal ID: ISSN 0377-0486
- Publisher:
- Wiley
- Country of Publication:
- United States
- Language:
- English
- Subject:
- catalysis (homogeneous), catalysis (heterogeneous), biofuels (including algae and biomass), bio-inspired, materials and chemistry by design, synthesis (novel materials), synthesis (scalable processing)
Citation Formats
Kim, Taejin, Assary, Rajeev S., Curtiss, Larry A., Marshall, Christopher L., and Stair, Peter C. Vibrational properties of levulinic acid and furan derivatives: Raman spectroscopy and theoretical calculations. United States: N. p., 2011.
Web. doi:10.1002/jrs.2951.
Kim, Taejin, Assary, Rajeev S., Curtiss, Larry A., Marshall, Christopher L., & Stair, Peter C. Vibrational properties of levulinic acid and furan derivatives: Raman spectroscopy and theoretical calculations. United States. https://doi.org/10.1002/jrs.2951
Kim, Taejin, Assary, Rajeev S., Curtiss, Larry A., Marshall, Christopher L., and Stair, Peter C. 2011.
"Vibrational properties of levulinic acid and furan derivatives: Raman spectroscopy and theoretical calculations". United States. https://doi.org/10.1002/jrs.2951.
@article{osti_1380910,
title = {Vibrational properties of levulinic acid and furan derivatives: Raman spectroscopy and theoretical calculations},
author = {Kim, Taejin and Assary, Rajeev S. and Curtiss, Larry A. and Marshall, Christopher L. and Stair, Peter C.},
abstractNote = {},
doi = {10.1002/jrs.2951},
url = {https://www.osti.gov/biblio/1380910},
journal = {Journal of Raman Spectroscopy},
issn = {0377-0486},
number = 12,
volume = 42,
place = {United States},
year = {Tue May 10 00:00:00 EDT 2011},
month = {Tue May 10 00:00:00 EDT 2011}
}
Other availability
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.
Works referenced in this record:
Levulinic Acid as a Basic Chemical Raw Material
journal, August 1956
- Leonard, Reid H.
- Industrial & Engineering Chemistry, Vol. 48, Issue 8
Nanoparticles with Raman Spectroscopic Fingerprints for DNA and RNA Detection
journal, August 2002
- Cao, Y. C.
- Science, Vol. 297, Issue 5586
Dimensionally Modulated, Single-Crystalline LiMPO 4 (M= Mn, Fe, Co, and Ni) with Nano-Thumblike Shapes for High-Power Energy Storage
journal, February 2009
- Murugan, A. Vadivel; Muraliganth, T.; Ferreira, P. J.
- Inorganic Chemistry, Vol. 48, Issue 3
Furfuryl Alcohol Polymerization in H−Y Confined Spaces: Reaction Mechanism and Structure of Carbocationic Intermediates
journal, February 2008
- Bertarione, S.; Bonino, F.; Cesano, F.
- The Journal of Physical Chemistry B, Vol. 112, Issue 9
An Evaluation of Harmonic Vibrational Frequency Scale Factors
journal, November 2007
- Merrick, Jeffrey P.; Moran, Damian; Radom, Leo
- The Journal of Physical Chemistry A, Vol. 111, Issue 45
Predicted thermochemistry for chemical conversions of 5-hydroxymethylfurfural
journal, September 2010
- Assary, Rajeev S.; Redfern, Paul C.; Hammond, Jeff R.
- Chemical Physics Letters, Vol. 497, Issue 1-3
Micro-FTIR and Micro-Raman Studies of a Carbon Film Prepared from Furfuryl Alcohol Polymerization
journal, July 2009
- Bertarione, S.; Bonino, F.; Cesano, F.
- The Journal of Physical Chemistry B, Vol. 113, Issue 31
Surface Acidity and Properties of TiO 2 /SiO 2 Catalysts Prepared by Atomic Layer Deposition: UV−visible Diffuse Reflectance, DRIFTS, and Visible Raman Spectroscopy Studies
journal, June 2009
- Lu, Junling; Kosuda, Kathryn M.; Van Duyne, Richard P.
- The Journal of Physical Chemistry C, Vol. 113, Issue 28
Raney Ni-Sn Catalyst for H2 Production from Biomass-Derived Hydrocarbons
journal, June 2003
- Huber, G. W.
- Science, Vol. 300, Issue 5628
Mechanism of levulinic acid formation
journal, January 1985
- Horvat, Jaroslav; Klaić, Branimir; Metelko, Biserka
- Tetrahedron Letters, Vol. 26, Issue 17, p. 2111-2114
Lignocellulose conversion: an introduction to chemistry, process and economics
journal, January 2007
- Lange, Jean-Paul
- Biofuels, Bioproducts and Biorefining, Vol. 1, Issue 1, p. 39-48
Molecular/electronic structure–surface acidity relationships of model-supported tungsten oxide catalysts
journal, March 2007
- Kim, T.; Burrows, A.; Kiely, C.
- Journal of Catalysis, Vol. 246, Issue 2
Production of Platform Chemicals and Synthesis Gas from Biomass
journal, July 2007
- Kamm, B.
- Angewandte Chemie International Edition, Vol. 46, Issue 27
Identifying the isolated transition metal ions/oxides in molecular sieves and on oxide supports by UV resonance Raman spectroscopy
journal, May 2003
- Li, Can
- Journal of Catalysis, Vol. 216, Issue 1-2
Synthesis of Transportation Fuels from Biomass: Chemistry, Catalysts, and Engineering
journal, September 2006
- Huber, George W.; Iborra, Sara; Corma, Avelino
- Chemical Reviews, Vol. 106, Issue 9, p. 4044-4098
A kinetic study on the decomposition of 5-hydroxymethylfurfural into levulinic acid
journal, January 2006
- Girisuta, B.; Janssen, L. P. B. M.; Heeres, H. J.
- Green Chemistry, Vol. 8, Issue 8
Comparison between Optimized Geometries and Vibrational Frequencies Calculated by the DFT Methods
journal, January 1996
- El-Azhary, A. A.; Suter, H. U.
- The Journal of Physical Chemistry, Vol. 100, Issue 37
Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions
journal, May 2009
- Marenich, Aleksandr V.; Cramer, Christopher J.; Truhlar, Donald G.
- The Journal of Physical Chemistry B, Vol. 113, Issue 18, p. 6378-6396
Computational Studies of the Thermochemistry for Conversion of Glucose to Levulinic Acid
journal, July 2010
- Assary, Rajeev S.; Redfern, Paul C.; Hammond, Jeff R.
- The Journal of Physical Chemistry B, Vol. 114, Issue 27
Integrated Catalytic Conversion of γ-Valerolactone to Liquid Alkenes for Transportation Fuels
journal, February 2010
- Bond, J. Q.; Alonso, D. M.; Wang, D.
- Science, Vol. 327, Issue 5969, p. 1110-1114
Vibrational spectra of partially oriented molecules having two conformers in nematic and isotropic solutions: furfural and 2-chlorobenzaldehyde
journal, May 2005
- Rogojerov, M.; Keresztury, G.; Jordanov, B.
- Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Vol. 61, Issue 7
Catalytic conversion of biomass-derived carbohydrates to fuels and chemicals by formation and upgrading of mono-functional hydrocarbon intermediates
journal, September 2009
- West, Ryan M.; Kunkes, Edward L.; Simonetti, Dante A.
- Catalysis Today, Vol. 147, Issue 2
Factors Influencing the Quality of Carbon Coatings on LiFePO[sub 4]
journal, January 2007
- Wilcox, James D.; Doeff, Marca M.; Marcinek, Marek
- Journal of The Electrochemical Society, Vol. 154, Issue 5
Catalytic fast pyrolysis of glucose with HZSM-5: The combined homogeneous and heterogeneous reactions
journal, March 2010
- Carlson, Torren R.; Jae, Jungho; Lin, Yu-Chuan
- Journal of Catalysis, Vol. 270, Issue 1
Levulinic acid in organic synthesis
journal, January 1999
- Timokhin, Boris V.; Baransky, V. A.; Eliseeva, G. D.
- Russian Chemical Reviews, Vol. 68, Issue 1
Production of levulinic acid and use as a platform chemical for derived products
journal, February 2000
- Bozell, Joseph J.; Moens, L.; Elliott, D. C.
- Resources, Conservation and Recycling, Vol. 28, Issue 3-4, p. 227-239
Conversion of Furfuryl Alcohol into Ethyl Levulinate using Solid Acid Catalysts
journal, May 2009
- Lange, Jean-Paul; van de Graaf, Wouter D.; Haan, René J.
- ChemSusChem, Vol. 2, Issue 5
Harmonic Vibrational Frequencies: An Evaluation of Hartree−Fock, Møller−Plesset, Quadratic Configuration Interaction, Density Functional Theory, and Semiempirical Scale Factors
journal, January 1996
- Scott, Anthony P.; Radom, Leo
- The Journal of Physical Chemistry, Vol. 100, Issue 41