Browsing School of Chemistry (Scholarly Articles) by Title

Now showing items 45-64 of 347

    • CO2-responsive polyacrylamide copolymer vesicles with acid-sensitive morpholine moieties and large hydrophobic RAFT end-group 

      Chalmers, Benjamin A.; Magee, Christopher; Cheung, David L.; Zetterlund, Per B.; Aldabbagh, Fawaz (Elsevier, 2017-10-07)
      Sequential Reversible Addition Fragmentation Chain Transfer (RAFT) polymerizations using 2,2′-azobis[2-(2-imidazolin-2-yl)propane]dihydrochloride (VA-044) and 2-(dodecylthiocarbonothioylthio)-2-methylpropionic acid ...

    • Cocrystal forms of the BCS class IV drug sulfamethoxazole 

      Alsubaie, Moneerh; Aljohani, Marwah; Erxleben, Andrea; McArdle, Patrick (American Chemical Society, 2018-05-23)
      Sulfamethoxazole, smz, is an antibiotic that is classified as a Biopharmaceutics Classification System (BCS) class IV, low solubility and low permeability drug. Cocrystal formation has been examined in an attempt to improve ...

    • Coiled coil type neoglycoproteins presenting three lactose residues 

      Sweeney, Sinclair M.; Bullen, Gemma A.; Gillis, Richard B.; Adams, Gary G.; Rowe, Arthur J.; Harding, Stephen E.; Tucker, James H.R.; Peacock, Anna F.A.; Murphy, Paul V. (Elsevier, 2016-02-06)
      Scaffold design, synthesis and application are relevant for biomedical research. For example, multivalent interactions, such as those between cell surface glycoproteins and lectins can influence the potency and duration ...

    • Combining glycocluster synthesis with protein engineering: an approach to probe into the significance of linker length in a tandem-repeat-type lectin (galectin-4) 

      Andre, Sabine; Wang, Guan-Nan; Gabius, Hans-Joachim; Murphy, Paul V. (Elsevier, 2014-05-07)
      Complementarity in lectin-glycan interactions in situ is assumed to involve spatial features in both the lectin and the glycan, giving a functional meaning to structural aspects of the lectin beyond its carbohydrate-binding ...

    • The combustion kinetics of the lignocellulosic biofuel, ethyl levulinate 

      Ghosh, Manik Kumer; Howard, Mícheál Séamus; Zhang, Yingjia; Djebbi, Khalil; Capriolo, Gianluca; Farooq, Aamir; Curran, Henry J.; Dooley, Stephen (Elsevier, 2018-04-04)
      Ethyl levulinate (Ethyl 4-oxopentanoate) is a liquid molecule at ambient temperature, comprising of ketone and ethyl ester functionalities and is one of the prominent liquid fuel candidates that may be easily obtained from ...

    • Combustion of n-C3–C6 linear alcohols: An experimental and kinetic modeling study. Part I: Reaction classes, rate rules, model lumping, and validation 

      Pelucchi, M.; Namysl, S.; Ranzi, E.; Rodriguez, A.; Rizzo, C.; Somers, K. P.; Zhang, Y.; Herbinet, O.; Curran, Henry J.; Battin-Leclerc, F.; Faravelli, T. (American Chemical Society, 2020-10-27)
      This work (and the companion paper, Part II) presents new experimental data for the combustion of n-C3–C6 alcohols (n-propanol, n-butanol, n-pentanol, n-hexanol) and a lumped kinetic model to describe their pyrolysis and ...

    • Combustion of n-C3–C6 linear alcohols: An experimental and kinetic modeling study. Part II: Speciation measurements in a jet-stirred reactor, ignition delay time measurements in a rapid compression machine, model validation, and kinetic analysis 

      Pelucchi, M.; Namysl, S.; Ranzi, E.; Rodriguez, A.; Rizzo, C.; Somers, K. P.; Zhang, Y.; Herbinet, O.; Curran, Henry J.; Battin-Leclerc, F.; Faravelli, T. (American Chemical Society, 2020-10-27)
      This work presents new experimental data for n-C3–C6 alcohol, combustion (n-propanol, n-butanol, n-pentanol, n-hexanol). Speciation measurements have been carried out in a jet-stirred reactor (p = 107 kPa, T = 550–1100 K, ...

    • Comparative chemical kinetic analysis and skeletal mechanism generation for syngas combustion with NOx chemistry 

      Wang, Quan-De; Sun, Yanjin; Curran, Henry J. (American Chemical Society, 2019-12-09)
      Emission of nitrogen oxides (NOx) are one of the major environmental concerns arising from the combustion of syngas. Strategies to reduce emission and improve the efficiency of syngas combustion can be developed using ...

    • A comparative reactivity study of 1-alkene fuels from ethylene to 1-heptene 

      Dong, Shijun; Zhang, Kuiwen; Senecal, Peter K.; Kukkadapu, Goutham; Wagnon, Scott W.; Barrett, Stephen; Lokachari, Nitin; Panigaphy, Snehasish; Pitz, William J.; Curran, Henry J. (Elsevier, 2020-09-23)
      A comparative reactivity study of 1-alkene fuels from ethylene to 1-heptene has been performed using ignition delay time (IDT) measurements from both a high-pressure shock tube and a rapid compression machine, at an ...

    • A comparative study of the effect of varied reaction environments on a swirl stabilized flame geometry via optical measurements 

      Banyon, Colin; Rodriguez-Henriquez, Jose J.; Paterakis, George; Malliotakis, Zisis; Souflas, Konstantinos; Keramiotis, Christos; Vourliotakis, George; Mauss, Fabian; Curran, Henry J.; Skevis, George; Koutmos, Panagiotis; Founti, Maria (Elsevier, 2018-01-04)
      The present work is a part of a larger experimental campaign which examines the behaviour of various fuels on a swirl stabilized flame burner configuration. Overall, detailed speciation measurements and temperature ...

    • Comparison of performance of an earthen plate and nafion as membrane separators in dual chamber microbial fuel cells 

      Jana, Partha Sarathi; Ghangrekar, Makarand Madhao; Leech, Dónal (Universitatea Tehnica "Gheorghe Asachi" Iasi. Editura Politehnium, Romania, 2018-02)
      The performance of microbial fuel cells (MFC) employing an earthen plate as a membrane separator is compared to that using Nafion 117 in an identical up-flow dual-chambered cylindrical cell configuration. The MFC configuration ...

    • Comparison of the fluorescence behavior of a biocrude oil and crude petroleum oils 

      Ryder, Alan G. (ACS Publications (American Chemical Society), 2006-02-15)
      The production and characterization of biocrude and petroleum like products from natural, renewable resources such as oil-bearing plant seeds is an interesting area of research at the moment. The present article discusses ...

    • Comparison of the performance of several recent hydrogen combustion mechanisms 

      Olm, Carsten; Zsély, István; Pálvölgyi, Róbert; Varga, Tamás; Nagy, Tibor; Curran, Henry J.; Turányi, Tamás (Elsevier ScienceDirect, 2014-03-12)
      A large set of experimental data was accumulated for hydrogen combustion: ignition measurements in shock tubes (770 data points in 53 datasets) and rapid compression machines (229/20), concentration time profiles in flow ...

    • Comparison of the performance of several recent syngas combustion mechanisms 

      Olm, Carsten; Zsély, István Gy; Varga, Tamás; Curran, Henry J. (Elsevier ScienceDirect, 2015-01-22)
      A large set of experimental data was accumulated for syngas combustion: ignition studies in shock tubes (732 data points in 62 datasets) and in rapid compression machines (492/47), flame velocity determinations (2116/217) ...

    • A comprehensive cocrystal screening study of chlorothiazide 

      Aljohani, Marwah; Pallipurath, Anuradha R.; McArdle, Patrick; Erxleben, Andrea (American Chemical Society, 2017-09-01)
      Cocrystal formation of chlorothiazide (ctz) was screened with a variety of coformers with carboxyl, amide, hydroxyl, sulfonamide, pyridine, amidine, and amine functional groups. New cocrystals with acetamide (aca), benzamide ...

    • A comprehensive combustion chemistry study of 2,5-dimethylhexane 

      Sarathy, S. Mani; Javed, Tamour; Karsenty, Florent; Heufer, Alexander; Wang, Weijing; Park, Sungwoo; Elwardany, Ahmed; Farooq, Aamir; Westbrook, Charles K.; Pitz, William J.; Oehlschlaeger, Matthew A.; Dayma, Guillaume; Curran, Henry J.; Dagaut, Philippe (Elsevier ScienceDirect, 2014-01-16)
      Iso-paraffinic molecular structures larger than seven carbon atoms in chain length are commonly found in conventional petroleum, Fischer-Tropsch (FT), and other alternative hydrocarbon fuels, but little research has been ...

    • A comprehensive experimental and improved kinetic modeling study on the pyrolysis and oxidation of propyne 

      Panigrahy, Snehasish; Liang, Jinhu; Nagaraja, Shashank S.; Zuo, Zhaohong; Kim, Gihun; Dong, Shijun; Kukkadapu, Goutham; Pitz, William J.; Vasu, Subith S.; Curran, Henry J. (Elsevier, 2020-09-15)
      To improve our understanding of the combustion characteristics of propyne, new experimental data for ignition delay times (IDTs), pyrolysis speciation profiles and flame speed measurements are presented in this study. IDTs ...

    • A comprehensive experimental and kinetic modeling study of 1-and 2-pentene 

      Dong, Shijun; Zhang, Kuiwen; Ninnemann, Erik M.; Najjar, Ahmed; Kukkadapu, Goutham; Baker, Jessica; Arafin, Farhan; Wang, Zhandong; Pitz, William J.; Vasu, Subith S.; Sarathy, S. Mani; Senecal, Peter K.; Curran, Henry J. (Elsevier, 2020-10-15)
      1- and 2-pentene are components in gasoline and are also used as representative alkene components in gasoline surrogate fuels. Most of the available ignition delay time data in the literature for these fuels are limited ...

    • A comprehensive experimental and kinetic modeling study of 1-hexene 

      Dong, Shijun; Aul, Christopher; Gregoire, Claire; Cooper, Sean P.; Mathieu, Olivier; Petersen, Eric L.; Rodriguez, Jose; Mauss, Fabian; Wagno, Scott W.; Kukkadapu, Goutham; Pitz, William J.; Curran, Henry J. (Elsevier, 2021-06-13)
      It is important to understand the low-temperature chemistry of 1-hexene as it is used as a representative alkene component in gasoline surrogate fuels. Ignition delay times (IDTs) of 1-hexene measured in rapid compression ...

    • A comprehensive experimental and modeling study of isobutene oxidation 

      Zhou, Chong-Wen; Li, Yang; O'Connor, Eoin; Somers, Kieran P.; Thion, Sébastien; Keesee, Charles; Mathieu, Olivier; Petersen, Eric L.; DeVerter, Trent A.; Oehlschlaeger, Matthew A.; Kukkadapu, Goutham; Sung, Chih-Jen; Alrefae, Majed; Khaled, Fathi; Farooq, Aamir; Dirrenberger, Patricia; Glaude, Pierre-Alexandre Glaude; Battin-Leclerc, Frédérique; Santner, Jeffrey; Ju, Yiguang; Held, Timothy; Haas, Francis M.; Dryer, Frederick L.; Curran, Henry J. (Elsevier, 2016-03-17)
      Isobutene is an important intermediate in the pyrolysis and oxidation of higher-order branched alkanes, and it is also a component of commercial gasolines. To better understand its combustion characteristics, a series of ...