1,645 research outputs found

    On the Utility of the Inverse Gamma Distribution in Modeling Composite Fading Channels

    Get PDF
    We introduce a general approach to characterize composite fading models based on inverse gamma (IG) shadowing. We first determine to what extent the IG distribution is an adequate choice for modeling shadow fading, by means of a comprehensive test with field measurements and other distributions conventionally used for this purpose. Then, we prove that the probability density function and cumulative density function of any IG-based composite fading model are directly expressed in terms of a Laplace-domain statistic of the underlying fast fading model, and in some relevant cases, as a mixture of well-known state-of-the-art distributions. We exemplify our approach by presenting a composite IG/two-wave with diffuse power fading model, for which its statistical characterization is directly attained in a simple form.Universidad de Málaga. Campus de Excelencia Internacional Andalucía Tech

    Chiroptical Spectroscopy of C3 Molecules

    Get PDF
    The relevance of molecules with C3 symmetry comes from the fact of many of them, upon assembling as columnar helical macromolecules, are ideal platform for electro-optical devices, for example as liquid crystals. The properties of these devices are highly dependent of the structure of the bulk aggregates, and consequently they can be controlled by modifying the position and nature of the stereocenters in the molecular building blocks. In this work we present an electronic and vibrational chiroptical study on a series of star-shaped molecules based on the octopolar C3-symmetric 1,3,5-(phenylene-ethynylene)-benzene block.Universidad de Málaga, Campus de Excelencia Internacional Andalucía Tec

    Factores estructurales de la pared celular del forraje que afectan su digestibilidad

    Get PDF
    La naturaleza de enlaces cruzados de los componentes de la pared celular y la cantidad de lignina y taninos condensados pueden ser los factores clave que limiten su degradación; sin embargo, la organizaci ón de la matriz puede regular el grado de influencia de la lignina sobre la degradación de los polisacáridos de la pared. Su efecto parece no ser igual en arbustos y pastos. El impedimento estérico parece ser el mecanismo principal que limita la degradación. Esto parece aplicarse a arbustos nativos de zonas áridas, la identificación de factores limitantes específicos, como la lignina y los taninos, pueden contribuir a incrementar la utilización de la energía de la pared celular del forraje

    Description of some families of filiform Lie algebras

    Get PDF
    In this paper we describe some families of filiform Lie algebras by giving a method which allows to obtain them in any arbitrary dimension n starting from the triple (p, q, m), where m = n and p and q are, respectively, invariants z1 and z2 of those algebras. After obtaining the general law of complex filiform Lie algebras corresponding to triples (p, q, m), some concrete examples of this method are shown

    Modeling the effect of the electrode potential in SERS by electronic structure calculations.

    Get PDF
    Surface Enhanced Raman Spectroscopy (SERS), due to the ability of greatly intensify the weak Raman signal of molecules adsorbed to metal surfaces, has proven to be a very useful tool to investigate changes in the electronic structure of metal-molecule surface complex. A deep knowledge of the electronic structure of these metal-molecule hybrid systems is key in electrochemistry, catalysis, plasmonics, molecular electronics, and in the development of selective and ultra-sensitive analytical sensors. The origin of this huge enhancement in SERS is due to two contributions: the electromagnetic (EM), related to surface plasmons, and the chemical mechanism, due to resonant charge transfer (CT) process between the adsorbate and the metal (CTSERS). Unfortunately, the SERS implies very complex phenomena where the molecule and the metal nanoparticle are involved. This fact makes challenging to build realistic theoretical models that take into account both the metal and the molecule at quantum level. We propose a methodology, based on DFT and ab initio electronic calculations, to simulate the effect of the electrode potential on the absorption, on the charge transfer states energies, and on the electronic excitations in metal-molecule hybrid systems from a microscopic point of view. This methodology consists on the prediction of Raman intensities from ab initio calculations of the geometries or the energy gradients at the excited states Franck-Condon point, bringing the possibility to predict the intensities in CTSERS as well as in resonance Raman without the need to know the excited state geometries, not always feasible to compute. The microscopic model adopted to mimic the effect of the interphase electric potential consist in a molecule adsorbed to a linear silver cluster [Agn-Adsorbate]q, were n is the number of silver atoms, and the total charge of the system (q) is zero for n=2 and q=±1 for n=1, 3 and 7.Universidad de Málaga. Campus de Excelencia Internacional Andalucía Tech

    Formación profesional para el empleo de los jóvenes

    Get PDF
    Premio extraordinario de Trabajo Fin de Máster curso 2014-2015. Políticas Territoriales de Emple

    SERS study of different species of p-aminothiophenol adsorbed on silver nanoparticles

    Get PDF
    In the present work we have focused the discussion on the experimental and theoretical SERS spectra of the organic compound pATP recorded on silver colloids. The huge SERS of pATP on metal substrates is significantly different from its ordinary Raman spectra due to the formation of a new specie namely p,p’ –dimercaptoazobenzene (DMAB). The features of the SERS spectra of pATP are strongly dependent on many factors as i.e. the laser power density or the laser wavelength but there are still important aspects to understand as, for example, the effect of the concentration that has already been studied before by our group. In this case we have analyzed the effect of the concentration at different wavelengths on the SERS spectra of pATP on silver nanoparticles.Universidad de Málaga. Campus de Excelencia Internacional Andalucía Tech

    Diseño óptimo de elementos mecánicos usando algoritmos de crecimiento biológico

    Get PDF
    En el diseño de componentes mecánicos se encuentran frecuentemente cambios de geometría no uniformes que junto con las inclusiones y defectos dentro de los materiales pueden dar lugar a un incremento en el valor de los esfuerzos. La distribución de estos esfuerzos en piezas con geometría compleja se puede predecir y es deseable optimizar las zonas en donde estos se concentran. Se describe el uso de algoritmos de crecimiento biológico en un ambiente de elemento finito para modificar geometrías modeladas con matemática de superficies libres y curvas splines para poder alcanzar la distribución uniforme y optimizada de esfuerzos que se encuentra en la naturaleza. Convirtiendo así al diseño mecánico en un “diseño biológico”

    Optimizing Reflux Synthesis Method of Mo-V-Te-Nb mixed oxide Catalysts for Light Alkane Selective Oxidation

    Full text link
    [EN] The investigation here presented studies the effect of the synthesis temperature (from 80 to 110 degrees C) and the time (from 1 to 4 days) employed to precipitate catalyst precursors by reflux method, on the physic-chemical and the catalytic properties of the resulting Mo-V-Te-Nb mixed oxide catalysts for both propane partial oxidation into acrylic acid and ethane oxidative dehydrogenation (ODH) to ethylene. The insight obtained has allowed an important optimization of the not commonly used reflux method to prepare Mo-V-Te-Nb oxide materials with competitive catalytic performance. The yields achieved overcome those from optimized catalysts prepared by conventional hydrothermal method, and approach those reached with catalysts prepared using the "slurry method". The optimum rise for the synthesis temperature is found as a key factor for the reflux method. It allows access to an increased vanadium content into the reflux precipitate, which favors the formation of a pseudo-amorphous Mo-V-Te-Nb oxometallate. This precipitate behaves as a precursor for the crystallization, during the solid-state activation step at high-temperature (600 degrees C/N-2), of the structure type (TeO)(2)M20O56 (M = Mo, V, Nb), key for the selective conversion of propane or ethane. On the other hand, for the optimum temperature of synthesis, i.e. 110 degrees C, higher synthesis time of the precursor leads to smaller crystal sizes in the final catalyst (higher specific surface areas) and lowers the average oxidation state of vanadium from V+5 to V+4, which significantly enhances the catalytic behavior.Authors gratefully acknowledge the funds from DGICYT (Spain) by the project RTI2018-099668-B-C21, as well as the funds from Comunidad de Madrid by the project 2017-T1/IND-6025 within the program "Atraccion y Retencion de Talento Investigador" of the V PRICIT.Massó Ramírez, A.; Ivars-Barceló, F.; López Nieto, JM. (2020). Optimizing Reflux Synthesis Method of Mo-V-Te-Nb mixed oxide Catalysts for Light Alkane Selective Oxidation. Catalysis Today. 356:322-329. https://doi.org/10.1016/j.cattod.2019.10.030S322329356Grasselli, R. K., Burrington, J. D., Buttrey, D. J., DeSanto Jr., P., Lugmair, C. G., Volpe Jr., A. F., & Weingand, T. (2003). Topics in Catalysis, 23(1/4), 5-22. doi:10.1023/a:1024859917786Chieregato, A., López Nieto, J. M., & Cavani, F. (2015). Mixed-oxide catalysts with vanadium as the key element for gas-phase reactions. Coordination Chemistry Reviews, 301-302, 3-23. doi:10.1016/j.ccr.2014.12.003Védrine, J. C., & Fechete, I. (2016). Heterogeneous partial oxidation catalysis on metal oxides. Comptes Rendus Chimie, 19(10), 1203-1225. doi:10.1016/j.crci.2015.09.021Sprung, C., Yablonsky, G., Schlögl, R., & Trunschke, A. (2018). Constructing A Rational Kinetic Model of the Selective Propane Oxidation Over A Mixed Metal Oxide Catalyst. Catalysts, 8(8), 330. doi:10.3390/catal8080330Grasselli, R. K. (2014). Site isolation and phase cooperation: Two important concepts in selective oxidation catalysis: A retrospective. Catalysis Today, 238, 10-27. doi:10.1016/j.cattod.2014.05.036López Nieto, J. M., Solsona, B., Concepción, P., Ivars, F., Dejoz, A., & Vázquez, M. I. (2010). Reaction products and pathways in the selective oxidation of C2–C4 alkanes on MoVTeNb mixed oxide catalysts. Catalysis Today, 157(1-4), 291-296. doi:10.1016/j.cattod.2010.01.046Ushikubo, T., Oshima, K., Kayou, A., & Hatano, M. (1997). Ammoxidation of propane over Mo-V-Nb-Te mixed oxide catalysts. Spillover and Migration of Surface Species on Catalysts, Proceedings of the 4th International Conference on Spillover, 473-480. doi:10.1016/s0167-2991(97)80871-3Tsuji, H., & Koyasu, Y. (2002). Synthesis of MoVNbTe(Sb)Ox Composite Oxide Catalysts via Reduction of Polyoxometalates in an Aqueous Medium. Journal of the American Chemical Society, 124(20), 5608-5609. doi:10.1021/ja0122344BOTELLA, P. (2004). Selective oxidative dehydrogenation of ethane on MoVTeNbO mixed metal oxide catalysts. Journal of Catalysis, 225(2), 428-438. doi:10.1016/j.jcat.2004.04.024J.M. López Nieto, P. Botella, M.I. Vázquez, A. Dejoz, Method for the oxidative dehydrogenation of ethane, US Patent 7,319,179 B2 (2008). J.M. López Nieto, P. Botella, M.I. Vázquez, A. Dejoz, Method for the oxidative dehydrogenation of ethane, EP 1,479,438 A1 (2004), assigned to CSIC and UPV.Dubois, J.-L. (2005). Selective oxidation of hydrocarbons and the global warming problem. Catalysis Today, 99(1-2), 5-14. doi:10.1016/j.cattod.2004.09.019Gaffney, A. M., & Mason, O. M. (2017). Ethylene production via Oxidative Dehydrogenation of Ethane using M1 catalyst. Catalysis Today, 285, 159-165. doi:10.1016/j.cattod.2017.01.020Botella, P., García-González, E., López Nieto, J. M., & González-Calbet, J. M. (2005). MoVTeNbO multifunctional catalysts: Correlation between constituent crystalline phases and catalytic performance. Solid State Sciences, 7(5), 507-519. doi:10.1016/j.solidstatesciences.2005.01.012CELAYASANFIZ, A., HANSEN, T., SAKTHIVEL, A., TRUNSCHKE, A., SCHLOGL, R., KNOESTER, A., … HAMID, S. (2008). How important is the (001) plane of M1 for selective oxidation of propane to acrylic acid? Journal of Catalysis, 258(1), 35-43. doi:10.1016/j.jcat.2008.05.028Nguyen, T. T., Deniau, B., Baca, M., & Millet, J.-M. M. (2016). Influence of Nb Content on the Structure, Cationic and Valence Distribution and Catalytic Properties of MoVTe(Sb)NbO M1 Phase Used as Catalysts for the Oxidation of Light Alkanes. Topics in Catalysis, 59(17-18), 1496-1505. doi:10.1007/s11244-016-0667-yBotella, P., López Nieto, J. M., Solsona, B., Mifsud, A., & Márquez, F. (2002). The Preparation, Characterization, and Catalytic Behavior of MoVTeNbO Catalysts Prepared by Hydrothermal Synthesis. Journal of Catalysis, 209(2), 445-455. doi:10.1006/jcat.2002.3648Vitry, D. (2003). Mo-V-Te-(Nb)-O mixed metal oxides prepared by hydrothermal synthesis for catalytic selective oxidations of propane and propene to acrylic acid. Applied Catalysis A: General, 251(2), 411-424. doi:10.1016/s0926-860x(03)00381-8Celaya Sanfiz, A., Hansen, T. W., Girgsdies, F., Timpe, O., Rödel, E., Ressler, T., … Schlögl, R. (2008). Preparation of Phase-Pure M1 MoVTeNb Oxide Catalysts by Hydrothermal Synthesis—Influence of Reaction Parameters on Structure and Morphology. Topics in Catalysis, 50(1-4), 19-32. doi:10.1007/s11244-008-9106-zBeato, P., Blume, A., Girgsdies, F., Jentoft, R. E., Schlögl, R., Timpe, O., … Mohd Salim, L. (2006). Analysis of structural transformations during the synthesis of a MoVTeNb mixed oxide catalyst. Applied Catalysis A: General, 307(1), 137-147. doi:10.1016/j.apcata.2006.03.014HIBST, H., ROSOWSKI, F., & COX, G. (2006). New Cs-containing Mo–V4+ based oxides with the structure of the M1 phase—Base for new catalysts for the direct alkane activation. Catalysis Today, 117(1-3), 234-241. doi:10.1016/j.cattod.2006.05.045Sanfiz, A. C., Hansen, T. W., Teschner, D., Schnörch, P., Girgsdies, F., Trunschke, A., … Hamid, S. B. A. (2010). Dynamics of the MoVTeNb Oxide M1 Phase in Propane Oxidation. The Journal of Physical Chemistry C, 114(4), 1912-1921. doi:10.1021/jp909352uKardash, T. Y., Lazareva, E. V., Svintsitskiy, D. A., Ishchenko, A. V., Bondareva, V. M., & Neder, R. B. (2018). The evolution of the M1 local structure during preparation of VMoNbTeO catalysts for ethane oxidative dehydrogenation to ethylene. RSC Advances, 8(63), 35903-35916. doi:10.1039/c8ra06424eConcepción, P., Hernández, S., & Nieto, J. M. L. (2011). On the nature of active sites in MoVTeO and MoVTeNbO catalysts: The influence of catalyst activation temperature. Applied Catalysis A: General, 391(1-2), 92-101. doi:10.1016/j.apcata.2010.05.011Baca, M., & Millet, J.-M. M. (2005). Bulk oxidation state of the different cationic elements in the MoVTe(Sb)NbO catalysts for oxidation or ammoxidation of propane. Applied Catalysis A: General, 279(1-2), 67-77. doi:10.1016/j.apcata.2004.10.014Lwin, S., Diao, W., Baroi, C., Gaffney, A., & Fushimi, R. (2017). Characterization of MoVTeNbOx Catalysts during Oxidation Reactions Using In Situ/Operando Techniques: A Review. Catalysts, 7(12), 109. doi:10.3390/catal7040109Ramli, I., Botella, P., Ivars, F., Pei Meng, W., Zawawi, S. M. M., Ahangar, H. A., … Nieto, J. M. L. (2011). Reflux method as a novel route for the synthesis of MoVTeNbOx catalysts for selective oxidation of propane to acrylic acid. Journal of Molecular Catalysis A: Chemical, 342-343, 50-57. doi:10.1016/j.molcata.2011.04.009BOTELLA, P., DEJOZ, A., LOPEZNIETO, J., CONCEPCION, P., & VAZQUEZ, M. (2006). Selective oxidative dehydrogenation of ethane over MoVSbO mixed oxide catalysts. Applied Catalysis A: General, 298, 16-23. doi:10.1016/j.apcata.2005.09.018Leclaire, A., Borel, M. M., Chardon, J., & Raveau, B. (1995). A mixed valent Keggin polyoxometallate involving molybdenum and tungsten. Materials Research Bulletin, 30(9), 1075-1080. doi:10.1016/0025-5408(95)00103-4Corella-Ochoa, M. N., Miras, H. N., Kidd, A., Long, D.-L., & Cronin, L. (2011). Assembly of a family of mixed metal {Mo : V} polyoxometalates templated by TeO32−: {Mo12V12Te3}, {Mo12V12Te2} and {Mo17V8Te}. Chemical Communications, 47(31), 8799. doi:10.1039/c1cc12782aBotella, P., López Nieto, J. M., & Solsona, B. (2002). Catalysis Letters, 78(1/4), 383-387. doi:10.1023/a:1014973005107Mestl, G. (2002). In situ Raman spectroscopy for the characterization of MoVW mixed oxide catalysts. Journal of Raman Spectroscopy, 33(5), 333-347. doi:10.1002/jrs.843Dieterle, M., & Mestl, G. (2002). Raman spectroscopy of molybdenum oxides. Physical Chemistry Chemical Physics, 4(5), 822-826. doi:10.1039/b107046kKnoezinger, H., & Jeziorowski, H. (1978). Raman spectra of molybdenum oxide supported on the surface of aluminas. The Journal of Physical Chemistry, 82(18), 2002-2005. doi:10.1021/j100507a011SOLSONA, B., VAZQUEZ, M., IVARS, F., DEJOZ, A., CONCEPCION, P., & LOPEZNIETO, J. (2007). Selective oxidation of propane and ethane on diluted Mo–V–Nb–Te mixed-oxide catalysts. Journal of Catalysis, 252(2), 271-280. doi:10.1016/j.jcat.2007.09.019Nguyen, T. T., Burel, L., Nguyen, D. L., Pham-Huu, C., & Millet, J. M. M. (2012). Catalytic performance of MoVTeNbO catalyst supported on SiC foam in oxidative dehydrogenation of ethane and ammoxidation of propane. Applied Catalysis A: General, 433-434, 41-48. doi:10.1016/j.apcata.2012.04.03
    corecore