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Vadim V. Ilyushin, Zbigniew Kisiel, Lech Pszczolkowski, Heinrich Maeder, Jon T. Hougen
A new program is described for fitting rotation-torsion energy levels in the molecules like toluene, in which the frame (C6H5) has C2v symmetry and the methyl top has C3v symmetry, i.e., for molecules where the internal rotation barrier is expanded in
Jennifer M. Lynch, Antonia M. Calafat, Kayoko Kato, Mark E. Ellefson, William K. Reagen, Mark Strynar, Steven G. O'Connell, Craig M. Butt, Scott Mabury, Jeff Small, D.C.G. Muir, Stefan D. Leigh, Michele M. Schantz
Standard Reference Materials (SRMs) are homogeneous, well-characterized materials that are used to validate measurement methods and are critical in improving data quality. Disagreements in perfluorinated alkyl acid (PFAA) concentrations measured in
Instrumental neutron activation analysis (INAA) as carried out at the National Institute of Standards and Technology (NIST) is inadequate for de-termining Al, Ni, and V at the levels found in the newly prepared Standard Reference Material (SRM) 1577c
We describe three gravimetric methods for accurately measuring the mass of picoliter-sized fluid droplets generated by a piezoelectric drop-on-demand (DOD) dispenser. Optical methods are also described for co-measurement of droplet diameters. Droplets are
C-reactive protein (CRP) is a serum analyte of clinical interest in ranges which are difficult to detect using standard mass spectrometry approaches. This paper describes a measurement procedure utilizing affinity purification of intact CRP prior to
We compare experimental and predicted thermophysical properties of two samples of rocket propellant RP-1 obtained from different batches of RP-1 that exhibit compositional variations. One sample is atypical, due to a high olefin content. The effect of the
Senescence of retinal pigment epithelial (RPE) cells is a crucial event in the pathogenesis of age-related macular degeneration (AMD). This study was design to improve the understanding of changes that underlie the RPE senescence. The levels of various
Okan Esenturk, Joseph S. Melinger, Paul A. Lane, Edwin J. Heilweil
Alternating multi-layer and 1:1 blended films of zinc phthalocyanine (ZnPc)and buckminsterfullerene (C60) were investigated as model active layers for solar cells by Time-Resolved Terahertz Spectroscopy (TRTS). Relative photon-to-carrier efficiencies 2
Spectrum simulation is a useful practical and pedagogical tool. Particularly with complex samples or trace constituents, a simulation can help to understand the limits of the technique and how to optimize the tools for the optimal measurement. DTSA-II
Laurent H. Coudert, Sergei P. Belov, F. Willaert, B. McElmurry, R. Lucchese, John W. Bevan, Jon T. Hougen
Observed rotational-vibrational transitions of HI dimer in the geared bending mode, centered at 511.9 GHz, are reported. This 50 kHz high resolution spectrum was recorded using a co-axially configured pulsed jet submillimeter spectrometer and the hyperfine
Zenkevich G. Igor, Valeri I. Babushok, Peter J. Linstrom, Edward White V, Stephen Stein
The effective use of gas chromatographic retention data presented in the form of reten¬tion indices (RI) requires the development of a compre¬hensive structure-based digital archive of retention parameters. Development of such an archive includes the
The decomposition kinetics of the kerosene-based rocket propellants RP-1 and RP-2 was studied. For RP-2, decomposition reactions were performed at 375, 400, 425, and 450 °C. For RP-1, decomposition reactions were only performed at 450 °C because we had
The thermal decomposition of RP-2 with three potential stabilizing additives was investigated. The additives were 1,2,3,4-tetrahydroquinoline (THQ), 1,2,3,4-tetrahydronaphthalene (tetralin) and the additive package that is used to make JP-8+100 (herein
Ryan G. Brennan, Savelas A. Rabb, Gregory C. Turk, Kaveh Jorabchi, William Rutkowski, Akbar Montaser
A heated ({approximately equal}90 °C) laminar flow interface has been designed to assist in the development of an electrospray sample introduction system for low-flow applications using inductively coupled plasma (ICP) spectrometry. This approach improves
Eun S. Park, William E. Wallace, Charles M. Guttman, Kathleen M. Flynn, Mickey Richardson, Gale A. Holmes
A method is presented to test whether the conversion of the mass spectrum of a polydisperse analyte to its molecular mass distribution is quantitative. Mixtures of samples with different average molecular masses, coupled with a Taylor's expansion
Francis J. Lovas, David F. Plusquellic, Brooks Pate, Justin L. Neill, Matt T. Muckle, Anthony J. Remijan
The microwave spectrum of the sugar alcohol 1,2-propanediol (CH3CHOHCH2OH) has been measured over the frequency range 6.5 GHz to 25.0 GHz with several pulsed-beam Fourier-transform microwave spectrometers. Seven conformers of 1,2-propanediol have been
Russell D. Johnson III, Karl K. Irikura, Raghu N. Kacker, Ruediger Kessel
To predict the vibrational spectra of molecules, ab initio calculations are often used to compute harmonic frequencies, which are usually scaled by empirical factors as an approximate correction for errors in the force constants and for anharmonic effects
We present a systematical investigation, both analytical and numerical, on the dynamics of two nearly lossless and distortion-free weak nonlinear optical pulses in a cold, lifetime-broadened four-state double-Λ system via electromagnetically induced
Measurements of the flow and the energy content of natural gas rely on equations of state to compute four thermodynamic properties: 1) compressibility factor; 2) critical flow factor; 3) speed of sound; and 4)isentropic exponent. We compare these computed
The calculation of natural gas viscosity has been implemented many different ways including the use of constants. Different methods of calculating natural gas viscosity may produce values with differences as large as 50%. Increasing natural gas prices
Mariona Coll Bau, Lauren H. Miller, Lee J. Richter, Daniel R. Hines, Curt A. Richter, Christina A. Hacker
The use of organic molecules to impart electrical surface properties has been a subject of intense research not only from a fundamental perspective but for many technological applications. In particular, organic molecules have been proposed as active
James W. Schmidt, Michael R. Moldover, Eric F. May
We used a quasi-spherical cavity resonator to measure the relative dielectric permittivity ε r of H 2 at frequencies from 2.4 GHz to 7.3 GHz, at pressures up to 6.5 MPa, and at the temperatures 273 K and 293 K. The resonator was calibrated using auxiliary
The use of purge and trap methods for sampling volatile organic compounds prior to chromatographic analysis is a mature technology. Application to low volatility compounds has been far less facile and sensitive. Especially problematic has been applications
Adolfas K. Gaigalas, Lili Wang, Hua-Jun He, Paul C. DeRose
This work describes a procedure for acquiring a spectrum of an analyte over an extended range of wavelengths and validating the wavelength and intensity assignments. To acquire a spectrum over an extended range of wavelengths with a spectrometer with a CCD