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At least 235 records · Page 13

Improving Collision Induced Dissociation (CID), High Energy Collision Dissociation (HCD), and Electron Transfer Dissociation (ETD) Fourier Transform MS/MS Degradome-Peptidome Identifications Using High Accuracy Mass Information

Identification of peptides through analysis of peptide ion fragmentation mass spectra is key to proteomic/peptidomic studies. Advanced mass spectrometry has enabled measurement of peptide fragments with {approx}ppm mass error levels; however, mass accuracy has not been widely utilized in broad aspects of peptide identification. In this work we describe how peptide high-precision fragments measured with Fourier transform mass spectrometry can provide a powerful discriminative capability to distinguish true peptide 'hits' from possible incorrect peptides. For identification of peptides having multiple termini and carrying multiple charges, we show that the simple utilization of high-precision mass fragments information results in improved peptide analysis coverage and consistency, with coverage of >95% peptides identified totally from different spectral scoring and peptide statistic probability methods developed for moderate accuracy mass spectral peptide identification.

59 BASIC BIOLOGICAL SCIENCES↗

Identifying surface structural changes in layered Li-excess nickel manganese oxides in high voltage lithium ion batteries: A joint experimental and theoretical study

High voltage cathode materials Li-excess layered oxide compounds Li[Ni{sub x}Li{sub 1/3-2x/3}Mn{sub 2/3-x/3}]O{sub 2} (0 < x < 1/2) are investigated in a joint study combining both computational and experimental methods. The bulk and surface structures of pristine and cycled samples of Li[Ni{sub 1/5}Li{sub 1/5}Mn{sub 3/5}]O{sub 2} are characterized by synchrotron X-Ray diffraction together with aberration corrected Scanning Transmission Electron Microscopy (a-S/TEM). Electron Energy Loss Spectroscopy (EELS) is carried out to investigate the surface changes of the samples before/after electrochemical cycling. Combining first principles computational investigation with our experimental observations, a detailed lithium de-intercalation mechanism is proposed for this family of Li-excess layered oxides. The most striking characteristics in these high voltage high energy density cathode materials are (1) formation of tetrahedral lithium ions at voltage less than 4.45 V and (2) the transition metal (TM) ions migration leading to phase transformation on the surface of the materials. We show clear evidence of a new spinel-like solid phase formed on the surface of the electrode materials after high-voltage cycling. It is proposed that such surface phase transformation is one of the factors contributing to the first cycle irreversible capacity and the main reason for the intrinsic poor rate capability of these materials.

74 ATOMIC AND MOLECULAR PHYSICS↗

High external quantum efficiency and fill-factor InGaN/GaN heterojunction solar cells grown by NH 3 -based molecular beam epitaxy

High external quantum efficiency (EQE) p-i-n heterojunction solar cellsgrown by NH 3 -based molecular beam epitaxy are presented. EQE values including optical losses are greater than 50% with fill-factors over 72% when illuminated with a 1 sun AM0 spectrum. Optical absorptionmeasurements in conjunction with EQE measurements indicate an internal quantum efficiency greater than 90% for the InGaN absorbing layer. By adjusting the thickness of the top p-type GaN window contact layer, it is shown that the short-wavelength (<365 nm) quantum efficiency is limited by the minority carrier diffusion length in highly Mg-doped p-GaN.

14 SOLAR ENERGY↗

Application of a new composite cubic-boron nitride gasket assembly for high pressure inelastic x-ray scattering studies of carbon related materials

We have developed a new composite cubic-boron nitride (c-BN) gasket assembly for high pressure diamond anvil cell studies, and applied it to inelastic x-ray scattering (IXS) studies of carbon related materials in order to maintain a larger sample thickness and avoid the interference from the diamond anvils. The gap size between the two diamond anvils remained {approx}80 {micro}m at 48.0 GPa with this new composite c-BN gasket assembly. The sample can be located at the center of the gap, {approx}20 {micro}m away from the surface of both diamond anvils, which provides ample distance to separate the sample signal from the diamond anvils. The high pressure IXS of a solvated C{sub 60} sample was studied up to 48 GPa, and a pressure induced bonding transition from sp{sup 2} to sp{sup 3} was observed at 27 GPa.

36 MATERIALS SCIENCE↗

The high-β{sub N} hybrid scenario for ITER and FNSF steady-state missions

New experiments on DIII-D have demonstrated the steady-state potential of the hybrid scenario, with 1 MA of plasma current driven fully non-inductively and β{sub N} up to 3.7 sustained for ∼3 s (∼1.5 current diffusion time, τ{sub R}, in DIII-D), providing the basis for an attractive option for steady-state operation in ITER and FNSF. Excellent confinement is achieved (H{sub 98y2} ∼ 1.6) without performance limiting tearing modes. The hybrid regime overcomes the need for off-axis current drive efficiency, taking advantage of poloidal magnetic flux pumping that is believed to be the result of a saturated 3/2 tearing mode. This allows for efficient current drive close to the axis, without deleterious sawtooth instabilities. In these experiments, the edge surface loop voltage is driven down to zero for >1 τ{sub R} when the poloidal β is increased above 1.9 at a plasma current of 1.0 MA and the ECH power is increased to 3.2 MW. Stationary operation of hybrid plasmas with all on-axis current drive is sustained at pressures slightly above the ideal no-wall limit, while the calculated ideal with-wall MHD limit is β{sub N} ∼ 4–4.5. Off-axis Neutral Beam Injection (NBI) power has been used to broaden the pressure and current profiles in this scenario, seeking to take advantage of higher predicted kink stability limits and lower values of the tearing stability index Δ′, as calculated by the DCON and PEST3 codes. Results based on measured profiles predict ideal limits at β{sub N} > 4.5, 10% higher than the cases with on-axis NBI. A 0-D model, based on the present confinement, β{sub N} and shape values of the DIII-D hybrid scenario, shows that these plasmas are consistent with the ITER 9 MA, Q = 5 mission and the FNSF 6.7 MA scenario with Q = 3.5. With collisionality and edge safety factor values comparable to those envisioned for ITER and FNSF, the high-β{sub N} hybrid represents an attractive high performance option for the steady-state missions of these devices.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Calibration of the OHREX high-resolution imaging crystal spectrometer at the Livermore electron beam ion traps

We report the calibration of the Orion High-Resolution X-ray (OHREX) imaging crystal spectrometer at the EBIT-I electron beam ion trap at Livermore. Two such instruments, dubbed OHREX-1 and OHREX-2, are fielded for plasma diagnostics at the Orion laser facility in the United Kingdom. The OHREX spectrometer can simultaneously house two spherically bent crystals with a radius of curvature of r = 67.2 cm. The focusing properties of the spectrometer allow both for larger distance to the source due to the increase in collected light and for observation of extended sources. OHREX is designed to cover a 2.5°–3° spectral range at Bragg angles around 51.3°. The typically high resolving powers at these large Bragg angles are ideally suited for line shape diagnostics. For instance, the nominal resolving power of the instrument (>10 000) is much higher than the effective resolving power associated with the Doppler broadening due to the temperature of the trapped ions in EBIT-I. The effective resolving power is only around 3000 at typical EBIT-I conditions, which nevertheless is sufficient to set up and test the instrument’s spectral characteristics. We have calibrated the spectral range for a number of crystals using well known reference lines in the first and second order and derived the ion temperatures from these lines. We have also made use of the 50 μm size of the EBIT-I source width to characterize the spatial focusing of the spectrometer.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

SIMULATIONS OF HIGH-VELOCITY CLOUDS. II. ABLATION FROM HIGH-VELOCITY CLOUDS AS A SOURCE OF LOW-VELOCITY HIGH IONS

In order to determine if the material ablated from high-velocity clouds (HVCs) is a significant source of low-velocity high ions (C IV, N V, and O VI) such as those found in the Galactic halo, we simulate the hydrodynamics of the gas and the time-dependent ionization evolution of its carbon, nitrogen, and oxygen ions. Our suite of simulations examines the ablation of warm material from clouds of various sizes, densities, and velocities as they pass through the hot Galactic halo. The ablated material mixes with the environmental gas, producing an intermediate-temperature mixture that is rich in high ions and that slows to the speed of the surrounding gas. We find that the slow mixed material is a significant source of the low-velocity O VI that is observed in the halo, as it can account for at least {approx}1/3 of the observed O VI column density. Hence, any complete model of the high ions in the halo should include the contribution to the O VI from ablated HVC material. However, such material is unlikely to be a major source of the observed C IV, presumably because the observed C IV is affected by photoionization, which our models do not include. We discuss a composite model that includes contributions from HVCs, supernova remnants, a cooling Galactic fountain, and photoionization by an external radiation field. By design, this model matches the observed O VI column density. This model can also account for most or all of the observed C IV, but only half of the observed N V.

79 ASTRONOMY AND ASTROPHYSICS↗

Study of cosmic ray events with high muon multiplicity using the ALICE detector at the CERN Large Hadron Collider

ALICE is one of four large experiments at the CERN Large Hadron Collider near Geneva, specially designed to study particle production in ultra-relativistic heavy-ion collisions. Located 52 meters underground with 28 meters of overburden rock, it has also been used to detect muons produced by cosmic ray interactions in the upper atmosphere. Here, we present the multiplicity distribution of these atmospheric muons and its comparison with Monte Carlo simulations. Our analysis exploits the large size and excellent tracking capability of the ALICE Time Projection Chamber. A special emphasis is given to the study of high multiplicity events containing more than 100 reconstructed muons and corresponding to a muon areal density rho(mu) > 5.9 m(-2). Similar events have been studied in previous underground experiments such as ALEPH and DELPHI at LEP. While these experiments were able to reproduce the measured muon multiplicity distribution with Monte Carlo simulations at low and intermediate multiplicities, their simulations failed to describe the frequency of the highest multiplicity events. In this work we show that the high multiplicity events observed in ALICE stem from primary cosmic rays with energies above 10(16) eV and that the frequency of these events can be successfully described by assuming a heavy mass composition of primary cosmic rays in this energy range. Furthermore, the development of the resulting air showers was simulated using the latest version of QGSJET to model hadronic interactions. This observation places significant constraints on alternative, more exotic, production mechanisms for these events.

43 PARTICLE ACCELERATORS↗

Search for High Mass Resonances Decaying to Muon Pairs in {radical}(s)=1.96 TeV pp Collisions

We present a search for a new narrow, spin-1, high mass resonance decaying to {mu}{sup +}{mu}{sup -}+X, using a matrix-element-based likelihood and a simultaneous measurement of the resonance mass and production rate. In data with 4.6 fb{sup -1} of integrated luminosity collected by the CDF detector in pp collisions at {radical}(s)=1960 GeV, the most likely signal cross section is consistent with zero at 16% confidence level. We therefore do not observe evidence for a high mass resonance and place limits on models predicting spin-1 resonances, including M>1071 GeV/c{sup 2} at 95% confidence level for a Z{sup '} boson with the same couplings to fermions as the Z boson.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Liebermannite, KAlSi3 O8 , a new shock-metamorphic, high-pressure mineral from the Zagami Martian meteorite

© The Meteoritical Society, 2017. In this paper, we discuss the occurrence of liebermannite (IMA 2013-128), KAlSi3O8, a new, shock-generated, high-pressure tetragonal hollandite-type structure silicate mineral, in the Zagami basaltic shergottite meteorite. Liebermannite crystallizes in space group I4/m with Z = 2, cell dimensions of a = 9.15 ± 0.14 (1σ) Å, c = 2.74 ± 0.13 Å, and a cell volume of 229 ± 19 Å3 (for the type material), as revealed by synchrotron diffraction. In Zagami, liebermannite likely formed via solid-state transformation of primary igneous K-feldspar during an impact event that achieved pressures of ~20 GPa or more. The mineral name is in honor of Robert C. Liebermann, a high-pressure mineral physicist at Stony Brook University, New York, USA.

Ma, Chi↗

Superlattice photonic crystal as broadband solar absorber for high temperature operation

Here, a high performance solar absorber using a 2D tantalum superlattice photonic crystal (PhC) is proposed and its design is optimized for high-temperature energy conversion. In contrast to the simple lattice PhC, which is limited by diffraction in the short wavelength range, the superlattice PhC achieves solar absorption over broadband spectral range due to the contribution from two superposed lattices with different cavity radii. The superlattice PhC geometry is tailored to achieve maximum thermal transfer efficiency for a low concentration system of 250 suns at 1500 K reaching 85.0% solar absorptivity. In the high concentration case of 1000 suns, the superlattice PhC absorber achieves a solar absorptivity of 96.2% and a thermal transfer efficiency of 82.9% at 1500 K, amounting to an improvement of 10% and 5%, respectively, versus the simple square lattice PhC absorber. In addition, the performance of the superlattice PhC absorber is studied in a solar thermophotovoltaic system which is optimized to minimize absorber re-emission by reducing the absorber-to-emitter area ratio and using a highly reflective silver aperture.

14 SOLAR ENERGY↗

Analysis of transistor and snubber turn-off dynamics in high-frequency high-voltage high-power converters

Dc to dc converters which operate reliably and efficiently at switching frequencies high enough to effect substantial reductions in the size and weight of converter energy storage elements are studied. A two winding current or voltage stepup (buck boost) dc-to-dc converter power stage submodule designed to operate in the 2.5-kW range, with an input voltage range of 110 to 180 V dc, and an output voltage of 250 V dc is emphasized. In order to assess the limitations of present day component and circuit technologies, a design goal switching frequency of 10 kHz was maintained. The converter design requirements represent a unique combination of high frequency, high voltage, and high power operation. The turn off dynamics of the primary circuit power switching transistor and its associated turn off snubber circuitry are investigated.

Wilson, P. M.↗

A High Voltage, High Rep-Rate, High Duty Factor Stacked Transformer Modulator

A high voltage modulator has been built and installed at Fermi National Accelerator Laboratory for the purpose of driving the gun anode of the Tevatron Electron Lens (TEL). It produces a defined voltage for each of the 36 (anti)proton bunches. This modulator employs five transformers to produce high voltage at a high repetition rate and high duty factor. It is capable of outputting sustained complex waveforms having peak voltages over 6 kV and average periodic rates up to 450 kHz with voltage transitions occurring at 395 ns intervals. This paper describes key aspects of the hardware design and performance.

Saewert, G. W.↗

High susceptibility to adiabatic shear banding and high dynamic strength in tungsten heavy alloys with a high-entropy alloy matrix

The susceptibility to adiabatic shear banding (ASB) of tungsten heavy alloys (WHAs) is a key factor to determine their penetration performance for kinetic energy penetrators (KEPs). This work reports a novel WHA with strong susceptibility to ASB that uses a precipitation-hardening high-entropy alloy (HEA) as the binding phase of W particles. The results find that nanoscale L12 precipitates and high dislocation density in the matrix contribute a high dynamic yield strength of ~2300 MPa. Also, a narrow ASB with a width of ~12 μm forms in the novel WHA, which is only 6% of the width of ASB in traditional WHAs like W-NiFe, exhibiting a great susceptibility to ASB. The redissolution of precipitates into the matrix because of temperature rise during shearing could sharply soften the shearing location, which is suggested to be a very important factor of destabilizing mechanism to promote the development of ASB.

36 MATERIALS SCIENCE↗

Melting of Magnesium Borohydride under High Hydrogen Pressure: Thermodynamic Stability and Effects of Nanoconfinement

The thermodynamic stability and melting point of magnesium borohydride were probed under hydrogen pressures up to 1000 bar (100 MPa) and temperatures up to 400 °C. At 400 °C, Mg(BH4)2 was found to be chemically stable between 700 and 1000 bar H2, whereas under 350 bar H2 or lower pressures, the bulk material partially decomposed into MgH2 and MgB12H12. The melting point of solvent-free Mg(BH4)2 was estimated to be 367-375 °C, which was above previously reported values by 40-90 °C. Our results indicated that a high hydrogen backpressure is needed to prevent the decomposition of Mg(BH4)2 before measuring the melting point and that molten Mg(BH4)2 can exist as a stable liquid phase between 367 and 400 °C under hydrogen overpressures of 700 bar or above. The occurrence of a pure molten Mg(BH4)2 phase enabled efficient melt-infiltration of Mg(BH4)2 into the pores of porous templated carbons (CMK-3 and CMK-8) and graphene aerogels. Both transmission electron microscopy and small-angle X-ray scattering confirmed efficient incorporation of the borohydride into the carbon pores. The Mg(BH4)2@carbon samples exhibited comparable hydrogen capacities to bulk Mg(BH4)2 upon desorption up to 390 °C based on the mass of the active component; the onset of hydrogen release was reduced by 15-25 °C compared to the bulk. Importantly, melt-infiltration under hydrogen pressure was shown to be an efficient way to introduce metal borohydrides into the pores of carbon-based materials, helping to prevent particle agglomeration and formation of stable closo-polyborate byproducts.

White, James L.↗

Towards a microchannel-based X-ray detector with two-dimensional spatial and time resolution and high dynamic range

X-ray detectors that combine two-dimensional spatial resolution with a high time resolution are needed in numerous applications of synchrotron radiation. Most detectors with this combination of capabilities are based on semiconductor technology and are therefore limited in size. Furthermore, the time resolution is often realised through rapid time-gating of the acquisition, followed by a slower readout. Here, a detector technology is realised based on relatively inexpensive microchannel plates that uses GHz waveform sampling for a millimeter-scale spatial resolution and better than 100 ps time resolution. The technology is capable of continuous streaming of time- and location-tagged events at rates greater than 10(7) events per cm(2). Time-gating can be used for improved dynamic range.

Adams, Bernhard W.↗