Literature DB >> 23700355

PROGRESS IN DETAILED KINETIC MODELING OF THE COMBUSTION OF OXYGENATED COMPONENTS OF BIOFUELS.

Luc Sy Tran1, Baptiste Sirjean, Pierre-Alexandre Glaude, René Fournet, Frédérique Battin-Leclerc.   

Abstract

Due to growing environmental concerns and diminishing petroleum reserves, a wide range of oxygenated species has been proposed as possible substitutes to fossil fuels: alcohols, methyl esters, acyclic and cyclic ethers. After a short review the major detailed kinetic models already proposed in the literature for the combustion of these molecules, the specific classes of reactions considered for modeling the oxidation of acyclic and cyclic oxygenated molecules respectively, are detailed.

Entities:  

Keywords:  Biofuel; alcohol; combustion; detailed kinetic models; ester; ether; furan; gas-phase oxidation

Year:  2012        PMID： 23700355      PMCID： PMC3657721          DOI： 10.1016/j.energy.2011.11.013

Source DB:  PubMed          Journal:  Energy (Oxf)        ISSN： 0360-5442            Impact factor:   7.147


  25 in total

1.  Cytotoxic and mutagenic effects, particle size and concentration analysis of diesel engine emissions using biodiesel and petrol diesel as fuel.

Authors:  J Bünger; J Krahl; K Baum; O Schröder; M Müller; G Westphal; P Ruhnau; T G Schulz; E Hallier
Journal:  Arch Toxicol       Date:  2000-10       Impact factor: 5.153

2.  Process conditions for preparing methanol from cornstalk gas.

Authors:  Ling-Feng Zhu; Lei Du; Xin-Bao Li; Guo-Ting Li; Jie Zhang
Journal:  J Environ Sci (China)       Date:  2007       Impact factor: 5.565

3.  Detailed chemical kinetic modeling of cyclohexane oxidation.

Authors:  Emma J Silke; William J Pitz; Charles K Westbrook; Marc Ribaucour
Journal:  J Phys Chem A       Date:  2007-02-23       Impact factor: 2.781

4.  Detailed kinetic study of the ring opening of cycloalkanes by CBS-QB3 calculations.

Authors:  B Sirjean; P A Glaude; M F Ruiz-Lopez; R Fournet
Journal:  J Phys Chem A       Date:  2006-11-23       Impact factor: 2.781

5.  Experimental study of the oxidation of methyl oleate in a jet-stirred reactor.

Authors:  Sarah Bax; Mohammed Hichem Hakka; Pierre-Alexandre Glaude; Olivier Herbinet; Frédérique Battin-Leclerc
Journal:  Combust Flame       Date:  2010-06       Impact factor: 4.185

Review 6.  Biobutanol: an attractive biofuel.

Authors:  Peter Dürre
Journal:  Biotechnol J       Date:  2007-12       Impact factor: 4.677

7.  Theoretical kinetic study of the reactions of cycloalkylperoxy radicals.

Authors:  B Sirjean; P A Glaude; M F Ruiz-Lòpez; R Fournet
Journal:  J Phys Chem A       Date:  2009-06-25       Impact factor: 2.781

8.  An experimental and kinetic investigation of premixed furan/oxygen/argon flames.

Authors:  Zhenyu Tian; Tao Yuan; Rene Fournet; Pierre-Alexandre Glaude; Baptiste Sirjean; Frédérique Battin-Leclerc; Kuiwen Zhang; Fei Qi
Journal:  Combust Flame       Date:  2011-04       Impact factor: 4.185

9.  Effects of ethanol (E85) versus gasoline vehicles on cancer and mortality in the United States.

Authors:  Mark Z Jacobson
Journal:  Environ Sci Technol       Date:  2007-06-01       Impact factor: 9.028

10.  Production of dimethylfuran for liquid fuels from biomass-derived carbohydrates.

Authors:  Yuriy Román-Leshkov; Christopher J Barrett; Zhen Y Liu; James A Dumesic
Journal:  Nature       Date:  2007-06-21       Impact factor: 49.962
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  6 in total

1.  Thermodynamic DFT analysis of natural gas.

Authors:  Abel F G Neto; Muhammad N Huda; Francisco C Marques; Rosivaldo S Borges; Antonio M J C Neto
Journal:  J Mol Model       Date:  2017-07-14       Impact factor: 1.810

2.  Direct observation of realistic-temperature fuel combustion mechanisms in atomistic simulations.

Authors:  Kristof M Bal; Erik C Neyts
Journal:  Chem Sci       Date:  2016-05-05       Impact factor: 9.825

3.  Ab initio kinetics predictions for the role of pre-reaction complexes in hydrogen abstraction from 2-butanone by OH radicals.

Authors:  Yi Gao; Yang Zhao; Qingbao Guan; Fuke Wang
Journal:  RSC Adv       Date:  2020-09-08       Impact factor: 4.036

4.  Shock tube and chemical kinetic modeling study of the oxidation of 2,5-dimethylfuran.

Authors:  Baptiste Sirjean; René Fournet; Pierre-Alexandre Glaude; Frédérique Battin-Leclerc; Weijing Wang; Matthew A Oehlschlaeger
Journal:  J Phys Chem A       Date:  2013-01-31       Impact factor: 2.781

5.  Combustion chemistry and flame structure of furan group biofuels using molecular-beam mass spectrometry and gas chromatography - Part II: 2-Methylfuran.

Authors:  Luc-Sy Tran; Casimir Togbé; Dong Liu; Daniel Felsmann; Patrick Oßwald; Pierre-Alexandre Glaude; René Fournet; Baptiste Sirjean; Frédérique Battin-Leclerc; Katharina Kohse-Höinghaus
Journal:  Combust Flame       Date:  2014-03-01       Impact factor: 4.185

6.  Combustion chemistry and flame structure of furan group biofuels using molecular-beam mass spectrometry and gas chromatography - Part I: Furan.

Authors:  Dong Liu; Casimir Togbé; Luc-Sy Tran; Daniel Felsmann; Patrick Oßwald; Patrick Nau; Julia Koppmann; Alexander Lackner; Pierre-Alexandre Glaude; Baptiste Sirjean; René Fournet; Frédérique Battin-Leclerc; Katharina Kohse-Höinghaus
Journal:  Combust Flame       Date:  2014-03-01       Impact factor: 4.185
  6 in total

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