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Chemistry

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  • Published Date
Displaying 501 - 525 of 1916

International Comparison of a Hydrocarbon Gas Standard at the Picomol per Mol Level

February 6, 2014
Author(s)
George C. Rhoderick, David L. Duewer, Eric Apel, Annarita Baldan, Bradley Hall, Alice Harling, Detlev Helmig, Gwi S. Heo, Jacques Hueber, Mi E. Kim, Yong D. Kim, Benjamin Miller, Stephen Montzka, Daniel Reimer
Studies of climate change increasingly recognize the diverse influences of hydrocarbons in the atmosphere, including roles in particulates and ozone formation. Measurements of key non methane hydrocarbons (NMHCs) suggest atmospheric mole fractions ranging

A comparison of literature models for the oxidation of normal heptane

February 1, 2014
Author(s)
David A. Sheen, Wing Tsang
The development of detailed chemical kinetic models has proceeded unabated since the pioneering work of Dixon-Lewis and coworkers forty-five years ago. In that time, computational power has increased ten million-fold, and yet, we do not have a consensus on

Template synthesis of gold nanoparticles with an organic molecular cage

January 16, 2014
Author(s)
Ryan McCaffrey, Hai Long, Yinghua Jin, Aric Sanders, Wounjhang Park, Wei Zhang
We report a novel strategy for the controlled synthesis of gold nanoparticles (AuNPs) with narrow size distribution (1.9 plus or minus} 0.4 nm) through NP nucleation and growth inside the cavity of a well-defined three-dimensional, shape-persistent organic

Probing the intracellular glutathione redox potential using in-cell NMR spectroscopy

January 2, 2014
Author(s)
Steve Y. Rhieu, Aaron A. Urbas, Daniel W. Bearden, John P. Marino, Vytautas Reipa, Katrice A. Lippa
Non-invasive and real-time analysis of cellular redox processes has been greatly hampered by lack of suitable measurement techniques. Here we describe an in-cell nuclear magnetic resonance (NMR)-based method for measuring the intracellular glutathione

Correlation of rocket propulsion fuel properties with chemical composition using comprehensive two-dimensional gas chromatography with time-of-flight mass spectrometry followed by partial least squares regression analysis

December 30, 2013
Author(s)
Thomas J. Bruno, Benjamin Kehimkar, Jamin C. Hoggard, Luke C. Marney, M. C. Billingsley, C. G. Fraga, R. E. Synovec
There is an increased need to more fully assess and control the composition of kerosene-based rocket propulsion fuels such as RP-1. In particular, it is critical to make better quantitative connections among the following three attributes: fuel performance

Inhibition of DNA glycosylases via small molecule purine analogs

December 9, 2013
Author(s)
M Miral Dizdar, Aaron C. Jacobs, Ajit Jadhav, Dorjbal Dorjsuren, David Maloney, Anton Simeonov, Pawel Jaruga, Amanda K. McCullough, R. S. Lloyd
Following the formation of oxidatively-induced DNA damage, several DNA glycosylases are required to initiate repair of the base lesions that are formed. Recently, NEIL1 and other DNA glycosylases, including OGG1 and NTH1 were identified as potential

High-Accuracy Measurements of the Vapor Pressure of Ice Referenced to the Triple Point

December 6, 2013
Author(s)
Katarzyna E. Bielska, Daniel K. Havey, Gregory E. Scace, D Lisak, Allan H. Harvey, Joseph T. Hodges
The vapor pressure of hexagonal (Ih) ice was measured over the temperature range 175 K to 253.4 K and referenced to the value at the triple point of water. This experiment combined a highly accurate humidity generation system containing an ice-coated

Fluctuation Enhanced Sensing (FES) with a Nanostructured Semiconducting Metal Oxide Film for Gas Detection and Classification

October 31, 2013
Author(s)
Bulent Ayhan, Chiman Kwan, Jin Zhou, Laszlo Kish, Kurt D. Benkstein, Phillip H. Rogers, Stephen Semancik
The feasibility of fluctuation-enhanced sensing (FES) for the detection and classification of different gases by using a single microsensor has been experimentally demonstrated. A nanostructured semiconducting metal oxide film has been used as a

Connection between thermodynamics and dynamics of simple fluids in highly attractive pores

October 25, 2013
Author(s)
William P. Krekelberg, Vincent K. Shen, Daniel W. Siderius, Thomas M. Truskett, Jeffrey R. Errington
We investigate the structural and diffusive dynamics properties of a model fluid in highly-absorptive cylindrical pores. At subcritical temperatures, self diffusion displays three distinct regimes as a function of average pore density ρ: 1) a decrease in

Spectral line shapes investigation with Pound-Drever-Hall-locked frequency-stabilized cavity ring-down spectroscopy

October 23, 2013
Author(s)
A. Cygan, S. Wojtewicz, J. Domyslawska, Piotr Maslowski, Katarzyna E. Bielska, M. Piwinski, K. Stec, R.S. Trawinski, F Ozimek, C. Radzewicz, Hisashi Abe, T. Ido, Joseph T. Hodges, D Lisak, R. Ciurylo
A review of recent experiments involving a newly developed Pound-Drever-Hall-locked frequency-stabilized cavity ring-down spectroscopy (PDH-locked FS-CRDS) system is presented. By comparison to standard FS-CRDS, the PDH lock of the probe laser to the ring

The Seventh Industrial Fluid Properties Simulation Challenge

October 8, 2013
Author(s)
Riaz Ahmad, John K. Brennan, Kevin A. Frankel, Jonathan D. Moore, Joshua D. Moore, Raymond D. Mountain, Richard B. Ross, Vincent K. Shen, Nathan E. Schultz, Daniel Siderius, Kenneth D. Smith, Matthias Thommes
The primary goal of the seventy industrial fluid properties simulation challenge was to test the ability of molecular simulation methods to predict the adsorption of organic adsorbates in zeolite materials. Zeoliet adsorbents are used in a variety of

Trace water vapor analysis in specialty gases: sensor and spectroscopic approaches

July 1, 2013
Author(s)
Kristine A. Bertness, Mark W. Raynor, Kevin C. Cossel, Florian B. Adler, Jun Ye
The analysis of water vapor impurity is important in a number of specialty gas applications. However the main driver for the development and advancement of trace H 2O analysis techniques has been the microelectronics industry. The International Technology

Formation of Disk- and Stacked Disk-Like Self-Assembled Morphologies from Cholesterol Functionalized Aliphatic Polycarbonate Containing Amphiphilic Diblock Copolymers

June 10, 2013
Author(s)
Vivek M. Prabhu, Shrinivas Venkataraman, Ashlynn Lee, Yi Yan Yang, James Hedrick, Hareem Maune
In this study, a cholesterol functionalized aliphatic cyclic carbonate monomer, 2-(5-methyl-2-oxo-1,3-dioxane-5-carboxyloyloxy)ethyl carbamate (MTC-Chol) was synthesized. The organo-catalytic ring opening polymerization of MTC-Chol was accomplished by

Photochemical Properties of Some Cl-Containing Halogenated Alkanes

May 31, 2013
Author(s)
Vladimir L. Orkin, Victor Khamaganov, E. E. Kasimovskaya, A G. Guschin
Rate constants for the gas phase reactions of OH radicals with three partially halogenated alkanes, CHCl3 (kMC), CHFClCFCl2 (k122a), and CH2CFCl2 (k132c), were measured using a discharge flow – electron paramagnetic resonance technique over the temperature

Surface mediated assembly of small, metastable gold nanoclusters

May 27, 2013
Author(s)
John M. Pettibone, William A. Osborn, Konrad Rykaczewski, Albert A. Talin, John E. Bonevich, Jeffrey W. Hudgens
The unique properties of metallic nanoclusters are attractive for numerous commercial and industrial applications but are generally less stable than nanocrystals. Thus, developing methodologies for stabilizing nanoclusters and retaining their enhanced
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