Aviso: para depositar documentos, por favor, inicia sesión e identifícate con tu cuenta de correo institucional de la UCM con el botón MI CUENTA UCM. No emplees la opción AUTENTICACIÓN CON CONTRASEÑA
 

Excitation of vibrational quanta in furfural by intermediate-energy electrons

Simple item page
dc.contributor.authorJones, D. B.
dc.contributor.authorNeves, R.F.C.
dc.contributor.authorLopes, M. C. A.
dc.contributor.authorda Costa, R.F.
dc.contributor.authorVarella, M. T. do N.
dc.contributor.authorBettega, M. H. F.
dc.contributor.authorLima, M. A. P.
dc.contributor.authorGarcía, G.
dc.contributor.authorBlanco Ramos, Francisco
dc.contributor.authorBrunger, M. J.
dc.date.accessioned2023-06-18T06:49:53Z
dc.date.available2023-06-18T06:49:53Z
dc.date.issued2015-12-14
dc.description© 2015 AIP Publishing LLC. This work was supported by the Australian, Brazilian, and Spanish government funding agencies (ARC, CNPq, CAPES). D.B.J. thanks the ARC for a Discovery Early Career Researcher Award. R.F.C.N. acknowledges CNPq and Flinders University for financial asistance, while M.J.B. thanks CNPq for his "Special Visiting Professor" award. R.F.C., M.T.N.V., and M.A.P.L. acknowledge financial support from FAPESP, while R.F.C., M.T.N.V., M.H.F.B., M.C.A.L., and M.A.P.L. acknowledge financial support from CNPq. M.C.A.L. also acknowledges support from FAPEMIG. G.G. thanks the Spanish Ministerio de Economia y Competitividad under Project No. F152012-31230 and the European Union COST Action CM1301 for funding.
dc.description.abstractWe report cross sections for electron-impact excitation of vibrational quanta in furfural, at intermediate incident electron energies (20, 30, and 40 eV). The present differential cross sections are measured over the scattered electron angular range 10 degrees-90 degrees, with corresponding integral cross sections subsequently being determined. Furfural is a viable plant-derived alternative to petrochemicals, being produced via low-temperature plasma treatment of biomass. Current yields, however, need to be significantly improved, possibly through modelling, with the present cross sections being an important component of such simulations. To the best of our knowledge, there are no other cross sections for vibrational excitation of furfural available in the literature, so the present data are valuable for this important molecule. (C) 2015 AIP Publishing LLC.
dc.description.departmentDepto. de Estructura de la Materia, Física Térmica y Electrónica
dc.description.facultyFac. de Ciencias Físicas
dc.description.refereedTRUE
dc.description.sponsorshipMinisterio de Economía y Competitividad (MINECO)
dc.description.sponsorshipARC
dc.description.sponsorshipCNPq
dc.description.sponsorshipFAPESP
dc.description.sponsorshipCAPES
dc.description.sponsorshipFlinders University
dc.description.sponsorshipFAPEMIG
dc.description.sponsorshipEuropean Union
dc.description.statuspub
dc.eprint.idhttps://eprints.ucm.es/id/eprint/35665
dc.identifier.doi10.1063/1.4936631
dc.identifier.issn0021-9606
dc.identifier.officialurlhttp://dx.doi.org/10.1063/1.4936631
dc.identifier.relatedurlhttp://scitation.aip.org/
dc.identifier.urihttps://hdl.handle.net/20.500.14352/24338
dc.issue.number22
dc.journal.titleJournal of chemical physics
dc.language.isoeng
dc.publisherAmerican Institute of Physics
dc.relation.projectIDF152012-31230
dc.relation.projectIDCOST Action CM1301
dc.rights.accessRightsopen access
dc.subject.cdu539.1
dc.subject.keywordBeam irradiation pretreatment
dc.subject.keywordDifferential cross-sections
dc.subject.keywordEnzymatic-hydrolysis
dc.subject.keywordImpact excitation
dc.subject.keywordScattering
dc.subject.keywordpositron
dc.subject.keywordMolecules
dc.subject.keywordStates
dc.subject.keywordWater
dc.subject.keywordTetrahydrofuran
dc.subject.ucmFísica nuclear
dc.subject.unesco2207 Física Atómica y Nuclear
dc.titleExcitation of vibrational quanta in furfural by intermediate-energy electrons
dc.typejournal article
dc.volume.number143
dcterms.references1. K. F. Ness, R. E. Robson, M. J. Brunger, and R. D. White, J. Chem. Phys. 136, 024318 (2012).http://dx.doi.org/10.1063/1.3675921 2. J. de Urquijo, E. Basurto, A. M. Juárez, K. F. Ness, R. E. Robson, M. J. Brunger, and R. D. White, J. Chem. Phys. 141, 014308 (2014).http://dx.doi.org/10.1063/1.4885357 3. N. A. Garland, M. J. Brunger, G. Garcia, J. de Urquijo, and R. D. White, Phys. Rev. A 88, 062712 (2013).http://dx.doi.org/10.1103/PhysRevA.88.062712 4. R. D. White, M. J. Brunger, N. A. Garland, R. E. Robson, K. F. Ness, G. García, J. de Urquijo, and Z. Lj. Petrović, Eur. Phys. J. D 68, 125 (2014).http://dx.doi.org/10.1140/epjd/e2014-50085-7 5. T. P. T. Do, H. V. Duque, M. C. A. Lopes, D. A. Konovalov, R. D. White, M. J. Brunger, and D. B. Jones, J. Chem. Phys. 142, 124306 (2015).http://dx.doi.org/10.1063/1.4915888 6. H. V. Duque, T. P. T. Do, M. C. A. Lopes, D. A. Konovalov, R. D. White, M. J. Brunger, and D. B. Jones, J. Chem. Phys. 142, 124307 (2015).http://dx.doi.org/10.1063/1.4915889 7. H. V. Duque, L. Chiari, D. B. Jones, Z. Pettifer, G. B. da Silva, P. Limão-Vieira, F. Blanco, G. García, R. D. White, M. C. A. Lopes, and M. J. Brunger, J. Chem. Phys. 140, 214306 (2014).http://dx.doi.org/10.1063/1.4879779 8. D. B. Jones, L. Ellis-Gibbings, G. García, K. L. Nixon, M. C. A. Lopes, and M. J. Brunger, J. Chem. Phys. 143, 094304 (2015).http://dx.doi.org/10.1063/1.4929907 9. E. M. de Oliveira, S. d’A Sanchez, M. H. F. Bettega, A. P. P. Natalense, M. A. P. Lima, and M.T. do N. Varella, Phys. Rev. A 86, 020701(R) (2012).http://dx.doi.org/10.1103/PhysRevA.86.020701 10. E. M. de Oliveira, R. F. da Costa, S. d A. Sanchez, A. P. P. Natalense, M. H. F. Bettega, M. A. P. Lima, and M. T. do N. Varella, Phys. Chem. Chem. Phys. 15, 1682 (2013).http://dx.doi.org/10.1039/C2CP43375C 11. R. F. C. Neves, D. B. Jones, M. C. A. Lopes, K. L. Nixon, E. M. de Oliveira, R. F. da Costa, M. T. do N. Varella, M. H. F. Bettega, M. A. P. Lima, G. B. da Silva, and M. J. Brunger, J. Chem. Phys. 142, 194302 (2015).http://dx.doi.org/10.1063/1.4921038 12. R. F. C. Neves, D. B. Jones, M. C. A. Lopes, F. Blanco, G. García, K. Ratnavelu, and M. J. Brunger, J. Chem. Phys. 142, 194305 (2015).http://dx.doi.org/10.1063/1.4921313 13. A. G. Sanz, M. C. Fuss, A. Muñoz, F. Blanco, P. Limão-Vieira, M. J. Brunger, S. J. Buckman, and G. García, Int. J. Radiat. Biol. 88, 71 (2012).http://dx.doi.org/10.3109/09553002.2011.624151 14. R. D. White, W. Tattersall, G. Boyle, R. E. Robson, S. Dujko, Z. Lj. Petrovic, A. Bankovic, M. J. Brunger, J. P. Sullivan, S. J. Buckman, and G. Garcia, Appl. Radiat. Isotopes 83, 77 (2014).http://dx.doi.org/10.1016/j.apradiso.2013.01.008 15. A. Muñoz, F. Blanco, G. García, P. A. Thorn, M. J. Brunger, J. P. Sullivan, and S. J. Buckman, Int. J. Mass Spectrom. 277, 175 (2008).http://dx.doi.org/10.1016/j.ijms.2008.04.028 16. M. C. Fuss, L. Ellis-Gibbings, D. B. Jones, M. J. Brunger, F. Blanco, A. Muñoz, P. Limão-Vieira, and G. García, J. Appl. Phys. 117, 214701 (2015).http://dx.doi.org/10.1063/1.4921810 17. R. E. Robson, M. J. Brunger, S. J. Buckman, G. Garcia, Z. Lj. Petrović, and R. D. White, Sci. Rep. 5, 12674 (2015).http://dx.doi.org/10.1038/srep12674 18. J. Amorim, C. Oliveira, J. A. Souza-Corrêa, and M. A. Ridenti, Plasma Processes Polym. 10, 670 (2013).http://dx.doi.org/10.1002/ppap.201200158 19. N. Schultz-Jensen, F. Leipold, H. Bindslev, and A. Thomsen, Appl. Biochem. Biotechnol. 163, 558 (2011).http://dx.doi.org/10.1007/s12010-010-9062-5 20. P. A. Thorn, M. J. Brunger, P. J. O. Teubner, N. Diakomichalis, T. Maddern, M. A. Bolorizadeh, W. R. Newell, H. Kato, M. Hoshino, H. Tanaka, H. Cho, and Y.-K. Kim, J. Chem. Phys. 126, 064306 (2007).http://dx.doi.org/10.1063/1.2434166 21. M. J. Brunger, P. A. Thorn, L. Campbell, N. Diakomichalis, H. Kato, H. Kawahara, M. Hoshino, H. Tanaka, and Y.-K. Kim, Int. J. Mass Spectrom. 271, 80 (2008).http://dx.doi.org/10.1016/j.ijms.2007.09.005 22. T. P. T. Do, M. Leung, M. Fuss, G. Garcia, F. Blanco, K. Ratnavelu, and M. J. Brunger, J. Chem. Phys. 134, 144302 (2011).http://dx.doi.org/10.1063/1.3575454 23. H. V. Duque, L. Chiari, D. B. Jones, P. A. Thorn, Z. Pettifer, G. B. da Silva, P. Limão-Vieira, D. Duflot, M.-J. Hubin-Franskin, J. Delwiche, F. Blanco, G. García, M. C. A. Lopes, K. Ratnavelu, R. D. White, and M. J. Brunger, Chem. Phys. Lett. 608, 161 (2014).http://dx.doi.org/10.1016/j.cplett.2014.05.087 24. L. Chiari, H. V. Duque, D. B. Jones, P. A. Thorn, Z. Pettifer, G. B. da Silva, P. Limão-Vieira, D. Duflot, M.-J. Hubin-Franskin, J. Delwiche, F. Blanco, G. García, M. C. A. Lopes, K. Ratnavelu, R. D. White, and M. J. Brunger, J. Chem. Phys. 141, 024301 (2014).http://dx.doi.org/10.1063/1.4885856 25. Z. Mas̆ín, J. D. Gorfinkiel, D. B. Jones, S. M. Bellm, and M. J. Brunger, J. Chem. Phys. 136, 144310 (2012).http://dx.doi.org/10.1063/1.3702629 26. D. B. Jones, S. M. Bellm, P. Limão-Vieira, and M. J. Brunger, Chem. Phys. Lett. 535, 30 (2012).http://dx.doi.org/10.1016/j.cplett.2012.03.044 27. D. B. Jones, S. M. Bellm, F. Blanco, M. Fuss, G. García, P. Limão-Vieira, and M. J. Brunger, J. Chem. Phys. 137, 074304 (2012).http://dx.doi.org/10.1063/1.4743961 28. R. F. da Costa, E. M. de Oliveira, M. H. F. Bettega, M. T. do N. Varella, D. B. Jones, M. J. Brunger, F. Blanco, R. Colmenares, P. Limão-Vieira, G. García, and M. A. P. Lima, J. Chem. Phys. 142, 104304 (2015).http://dx.doi.org/10.1063/1.4913824 29. R. F. C. Neves, D. B. Jones, M. C. A. Lopes, K. L. Nixon, G. B. da Silva, H. V. Duque, E. M. de Oliveira, R. F. da Costa, M. T. do N. Varella, M. H. F. Bettega, M. A. P. Lima, K. Ratnavelu, G. García, and M. J. Brunger, J. Chem. Phys. 142, 104305 (2015).http://dx.doi.org/10.1063/1.4913825 30. A. S. Mamman, J.-M. Lee, Y.-C. Kim, I. T. Hwang, N.-J. Park, Y. K. Hwang, J.-S. Chang, and J.-S. Hwang, Biofuels, Bioprod. Biorefin. 2, 438 (2008).http://dx.doi.org/10.1002/bbb.95 31. H. Gomez Bernal, L. Bornazzami, and A. M. Raspolli Galletti, Green Chem. 16, 3734 (2014).http://dx.doi.org/10.1039/C4GC00450G 32. J.-P. Lange, E. van der Heide, J. van Buijtenen, and R. Price, ChemSusChem 5, 150 (2012).http://dx.doi.org/10.1002/cssc.201100648 33. A. J. Ragauskas, C. K. Williams, B. H. Davison, G. Britovsek, J. Cairney, C. A. Eckert, W. J. Frederick, J. P. Hallett, D. J. Leak, C. L. Liotta, J. R. Mielenz, R. Murphy, R. Templer, and T. Tschaplinski, Science 311, 484 (2006).http://dx.doi.org/10.1126/science.1114736 34. J. S. Bak, J. K. Ko, Y. H. Han, B. C. Lee, I.-G. Choi, and K. H. Kim, Bioresour. Technol. 100, 1285 (2009).http://dx.doi.org/10.1016/j.biortech.2008.09.010 35. A. W. Khan, J. P. Labrie, and J. McKeown, Biotechnol. Bioeng. 28, 1449 (1986).http://dx.doi.org/10.1002/bit.260280921 36. F. Ferreira da Silva, E. Lange, P. Limão-Vieira, N. C. Jones, S. V. Hoffmann, M.-J. Hubin-Franskin, J. Delwiche, M. J. Brunger, R. F. C. Neves, M. C. A. Lopes, E. M. de Oliveira, R. F. da Costa, M. T. do N. Varella, M. H. F. Bettega, F. Blanco, G. García, M. A. P. Lima, and D. B. Jones, J. Chem. Phys. 143, 144308 (2015).http://dx.doi.org/10.1063/1.4932603 37. D. B. Jones, E. Ali, K. L. Nixon, P. Limão-Vieira, M.-J. Hubin-Franskin, J. Delwiche, C. G. Ning, J. Colgan, A. J. Murray, D. H. Madison, and M. J. Brunger, J. Chem. Phys. 143, 184310 (2015).http://dx.doi.org/10.1063/1.4935444 38. L. R. Hargreaves, R. Albaridy, G. Serna, M. C. A. Lopes, and M. A. Khakoo, Phys. Rev. A 84, 062705 (2011).http://dx.doi.org/10.1103/PhysRevA.84.062705 39. O. Zatsarinny, K. Bartschat, G. Garcia, F. Blanco, L. R. Hargreaves, D. B. Jones, R. Murrie, J. R. Brunton, M. J. Brunger, M. Hoshino, and S. J. Buckman, Phys. Rev. A 83, 042702 (2011).http://dx.doi.org/10.1103/PhysRevA.83.042702 40. H. Kato, A. Suga, M. Hoshino, F. Blanco, G. García, P. Limão-Vieira, M. J. Brunger, and H. Tanaka, J. Chem. Phys. 136, 134313 (2012).http://dx.doi.org/10.1063/1.3699040 41. M. Fuss, A. G. Sanz, F. Blanco, P. Limão-Vieira, M. J. Brunger, and G. García, Eur. Phys. J. D 68, 161 (2014).http://dx.doi.org/10.1140/epjd/e2014-40820-5 42. M. J. Brunger and P. J. O. Teubner, Phys. Rev. A 41, 1413 (1990).http://dx.doi.org/10.1103/PhysRevA.41.1413 43. M. Rogojerov, G. Keresztury, and B. Jordanov, Spectrochim. Acta, Part A 61, 1661 (2005).http://dx.doi.org/10.1016/j.saa.2004.11.043 44. L. Campbell, M. J. Brunger, P. J. O. Teubner, B. Mojarrabi, and D. C. Cartwright, Aust. J. Phys. 50, 525 (1997).http://dx.doi.org/10.1071/P96060 45. M. Allan, J. Phys. B 38, 3655 (2005).http://dx.doi.org/10.1088/0953-4075/38/20/003 46. H. Tanaka, M. J. Brunger, L. Campbell, H. Kato, M. Hoshino, and A. R. P. Rau, “Utilizing scaled plane-wave Born cross sections for atoms and molecules,” Rev. Mod. Phys. (submitted). 47. See http://cccbdb.nist.gov/ for an IR spectrum. 48. R. F. da Costa, M. T. do N. Varella, M. H. F. Bettega, and M. A. P. Lima, Eur. Phys. J. D 69, 159 (2015).http://dx.doi.org/10.1140/epjd/e2015-60192-6 49. M. J. Brunger and S. J. Buckman, Phys. Rep. 357, 215 (2002).http://dx.doi.org/10.1016/S0370-1573(01)00032-1 50. R. F. da Costa, M. T. do N. Varella, M. H. F. Bettega, F. Blanco, G. García, D. B. Jones, M. J. Brunger, and M. A. P. Lima, “Elastic electron collisions with furfural: An investigation on the behaviour of the cross sections under the influence of multichannel coupling effects” (unpublished). 51. D. R. Lide, CRC Handbook of Chemistry and Physics, 90th ed. (CRC Press, Boca Raton, FL, 2010). 52. R. Rivelino, S. Canuto, and K. Coutinho, Braz. J. Phys. 34, 84 (2004).http://dx.doi.org/10.1590/S0103-97332004000100012 53. T. Jewison, C. Knox, V. Neveu, Y. Djoumbou, A. C. Guo, J. Lee, P. Liu, R. Mandal, R. Krishnamurthy, I. Sinelnikov, M. Wilson, and D. S. Wishart, Nucleic Acids Res. 40, D815 (2012).http://dx.doi.org/10.1093/nar/gkr916 54. A. Zecca, C. Perazzolli, and M. J. Brunger, J. Phys. B 38, 2079 (2005).http://dx.doi.org/10.1088/0953-4075/38/13/002 55. F. Blanco and G. García, Chem. Phys. Lett. 635, 321 (2005).http://dx.doi.org/10.1016/j.cplett.2015.06.066 56. M. C. Fuss, A. G. Sanz, F. Blanco, J. C. Oller, P. Limão-Vieira, M. J. Brunger, and G. García, Phys. Rev. A 88, 042702 (2013).http://dx.doi.org/10.1103/PhysRevA.88.042702 57. A. G. Sanz, M. C. Fuss, F. Blanco, J. D. Gorfinkiel, D. Almeida, F. Ferreira da Silva, P. Limão-Vieira, M. J. Brunger, and G. García, J. Chem. Phys. 139, 184310 (2013).http://dx.doi.org/10.1063/1.4829771 58. D. B. Jones, R. F. da Costa, M. T. do N. Varella, M. H. F. Bettega, M. A. P. Lima, F. Blanco, G. García, and M. J. Brunger, “Integral elastic, electronic-state, ionization and total cross sections for electron scattering with furfural” (unpublished). 59. D. B. Jones, R. F. C. Neves, M. C. A. Lopes, R. F. da Costa, M. T. do N. Varella, M. H. F. Bettega, M. A. P. Lima, F. Blanco, G. García, P. Limão-Vieira, and M. J. Brunger, “Theoretical and experimental differential cross sections for electron impact excitation of the electronic bands of furfural” (unpublished).
dspace.entity.typePublication
relation.isAuthorOfPublicationfd97b031-5b10-40ab-beb5-8f192e632ca3
relation.isAuthorOfPublication.latestForDiscoveryfd97b031-5b10-40ab-beb5-8f192e632ca3

Download

Original bundle

Now showing 1 - 1 of 1
Thumbnail Image
Name:
Blanco Ramos F 06 LIBRE.pdf
Size:
466.01 KB
Format:
Adobe Portable Document Format
downoload Download

Collections

Artículos