CASSCF-wave packet ab initio prediction of electronic and vibrational spectra - Application to the A2Pi-X2Sigma(+) absorption of C2H at 3000 K
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Reimers, J. R.↗
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Effect of adsorbed iron on thermoluminescence and electron spin resonance spectra of Ca-Fe-exchanged montmorillonite
The ESR spectra and the natural and gamma-induced thermoluminescence (TL) glow curves of a series of variably cation-exchanged Fe-Ca-clays prepared from SWy-1 montmorillonite were examined. The ESR signal intensity associated with surface Fe increased linearly with surface Fe content up to a nominal concentration of 50 percent exchangeable Fe. At above 50 percent exchangeable Fe, no appreciable increase in the signal was noted. The TL intensity decreased linearly with increasing surface Fe up to 50 percent nominal exchangeable Fe. At above 50 percent, the signal was not appreciably further diminished. Possible effects of Fe on quenching of TL are considered.
Coyne, Lelia M.↗
Temporal-Spatial Structure of Magnetic Merging at the Magnetopause Inferred from 557.7-nm All-Sky Images
We demonstrate that high-resolution 557.7-nm all-sky images are useful tools for investigating the spatial and temporal evolution of merging on the dayside magnetopause. Analysis of ground and satellite measurements leads us to conclude that high-latitude merging events can occur at multiple sites simultaneously and vary asynchronously on time scales of 30 s to 3 min. Variations of 557.7 nm emissions were observed at a 10 s cadence at Ny-Alesund on 19 December 2001, while significant changes in the IMF clock angle were reaching the magnetopause. The optical patterns are consistent with a scenario in which merging occurs around the rim of the high-latitude cusp at positions dictated by the IMF clock angle. Electrons energized at merging sites represent plausible sources for 557.7 nm emissions in the cusp. Polar observations at the magnetopause have directly linked enhanced fluxes of > or = 0.5 keV electrons with merging. Spectra of electrons responsible for some of the emissions, measured during a DMSP F15 overflight, exhibit "inverted-V" features, indicating further acceleration above the ionosphere. SuperDARN spectral width boundaries, characteristic of open-closed field line transitions, are located at the equatorward edge of the 557.7nm emissions. Optical data suggest that with IMF B(sub Y) > 0, the Northern Hemisphere cusp divides into three source regions. When the IMF clock angle was approx. 150 deg structured 557.7-nm emissions came from east of the 13:00 MLT meridian. At larger clock angles the emissions appeared between 12:00 and 13:00 MLT. No significant 557.7-nm emissions were detected in the prenoon MLT sector. MHD simulations corroborate our scenario, showing that with the observed large dipole-tilt and IMF clock angles, merging sites develop near the front and eastern portions of the high-altitude cusp rim in the Northern Hemisphere and near the western part of the cusp rim in the Southern Hemisphere.
Maynard, N. C.↗
Visible to Near Infrared Emission Spectra of Electron-Excited H2
The electron-impact induced fluorescence spectrum of H2 at 100 eV from 700 nm to 950 nm at a spectral resolution of between 0.2 nm to 0.3 nm has been measured. The laboratory spectrum has been compared with our theoretical simulated spectrum obtained by calculating the lines emission cross sections from the upper states of g symmetry (EF, GK, HH, P, O ; I, R, J, S ) towards the states of u symmetry (B, C, B', D) of H2. The nine above Born-Openheimer g-upper states have been coupled together as well as the four above Born-Openheimer u-lower states. The comparison seems adequate with few minor discrepancies.
Aguilar, A.↗
Experimental electron energy-loss spectra and cross sections for the 4/2/S - 4/2/P transition in Zn II
Electron energy-loss spectra and differential cross sections are reported for inelastic scattering from Zn II. Measurements were carried out in a crossed electron beam-ion beam apparatus, at incident electron energies of 30, 40, 50, 60, 75, 85, and 100 eV, and at a scattering angle of 14 deg. The present results are the first reported measurements of inelastic electron scattering from an ion.
Chutjian, A.↗
OGO-5 experiment E-09 cosmic ray electrons
Cosmic ray spectra and solar electron data in the 10 to 200 MeV range, as measured by experiment E-09 on OGO-5, are reported.
Meyer, P.↗
Estimates of trapped radiation encountered on low-thrust trajectories through the Van Allen belts
Estimates were made of the number of trapped protons and electrons encountered by vehicles on low-thrust trajectories through the Van Allen belts. The estimates serve as a first step in assessing whether these radiations present a problem to on-board sensitive components and payload. The integrated proton spectra and electron spectra are presented for the case of a trajectory described by a vehicle with a constant-thrust acceleration A sub c equal to 0.001 meter/sq sec. This value of acceleration corresponds to a trip time of about 54 days from low earth orbit to synchronous orbit. It is shown that the time spent in the belts and hence the radiation encountered vary nearly inversely with the value of thrust acceleration. Thus, the integrated spectral values presented for the case of A sub c = 0.001 meter/sq sec can be generalized for any other value of thrust acceleration by multiplying them by the factor 0.001/A sub c.
Karp, I. M.↗
Coincident particle observations from AE-C and ATS 6 during the October 28, 1977, geomagnetic storm
Simultaneous measurements of ion and electron energy spectra recorded during the October 28, 1977 geomagnetic storm by the AE-C and ATS 6 spacecraft when both were nearly on the same L shell are evaluated and compared. The orbit of the AE-C generates wide longitudinal coverage of the auroral oval, whereas the ATS 6, which is located at geosynchronous orbit, samples the equatorial particle population. It is shown that the coincident electron energy spectra obtained by the two satellites agree well above 5 keV and the spectra of electrons peak near 1 keV at ionospheric altitudes, while no peaks in energy appear at synchronous altitude.
Zanetti, L. J.↗
Energy spectra of the retrofugal electron flux from massive targets.
Electrons from linear accelerator directed in collimated beam at normal incidence upon thick targets of various materials, obtaining energy spectra of retrofugal electrons
ELECTRON FLUX↗
Electronic properties and optical spectra of donor–acceptor conjugated organic polymers
Organic semiconductors based on conjugated donor-acceptor (D–A) polymers are a unique platform for electronic, spintronic, and energy-harvesting devices. Understanding the electronic structure of D–A polymers with a small band gap is essential for developing next-generation technologies. Here, we investigate the electronic structure and optical spectra of cyclopentadithiophene-based closed/open-shell D–A polymers using density functional theory and the Bethe–Salpeter equation based on G 0 W 0 approximation. We explored the role of different acceptor units and chemical substitutions on the structural changes and, more importantly, electronic, optical, and dielectric behavior. We found that the computed first exciton peak of the polymers agreed well with the available experimentally measured optical gap. Furthermore, D–A polymers with open-shell character display higher dielectric constant than the closed-shell polymers. We show that the exceptional performance of polycyclopentadithiophene-thiophenylthiadiazoloquinoxaline (PCPDT-TTQ) as a scalable n-type material for Faradaic supercapacitors can be partly ascribed to its elevated dielectric constant. Consequently, these D–A polymers, characterized by their high dielectric constants, exhibit significant potential for various applications, including energy storage, organic electronics, and the production of dielectric films.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Plasma and energetic particles in the magnetotail at 60 earth radii
Particle measurements made by the lunar-orbiting Apollo subsatellites have shown that electron energy spectra in the range 0.55-320 keV in the high-latitude magnetotail often fit a power law with an exponent of -3 and a flux at .5 keV of 200,000 to 700,000 el/sq cm s sr keV. In the magnetosheath, electron energy spectra are similar to the high-latitude magnetotail spectra. In the plasma sheet, electron energy spectra often fit the high-energy tail of a Maxwellian distribution with Eo of about 200-500 eV. During times of substorms a number of cases where the plasma sheet appears to thin at onset have been observed. In addition, cases of plasma sheet expansion at onset have also been observed.
Chase, L. M.↗
Spatial aspects of low- and medium-energy electron degradation in N2
Spatial (radial and longitudinal) yield spectra for electron energy degradation in molecular nitrogen gas for 25-eV to 10-keV incident electrons have been generated by using a Monte Carlo technique. These spatial yield spectra associated with the electron degradation process can be employed to calculate a 'yield' for any inelastic state at any position in the medium. These have been analytically represented in terms of a model containing three simple 'microplumes'. Five-dimensional yield spectra which contain the information about the polar angle of the electron have also been analytically represented within the framework of the microplume model. Aeronomical and radiological applications of our model are discussed.
Singhal, R. F.↗
Synthesis of PbS/CdS/Cu 2-x S core/shell/shell quantum dots for rapid NIR emission.
Nanoscale semiconductors, known as quantum dots (QDs), possess unique size-tunable optical and electrical properties. With continued research into quantum information storage and quantum communication, the need for near-infrared single photon emitters and absorbers has gained prominence. Lead sulfide QDs have only recently been explored as a reliable near-infrared single photon emitters with the addition of a protective cadmium sulfide shell. Despite the increased air and room temperature stability of these QDs, long photon emission times have limited widespread application. This work examines the enhanced photon emission due to the Purcell effect provided by the layering of copper sulfide. In particle, this work synthesized lead sulfide cores in the 10 nm range, successfully layered cadmium sulfide through cation exchange, and attempted the cation exchange of copper sulfide, as identified with near-infrared absorbance spectra, transmission electron microscopy, and photoluminescence spectra.
36 MATERIALS SCIENCE↗
Evidence for parallel electric field particle acceleration in the dayside auroral oval
Electron and ion energy spectra and electron pitch angle distributions are presented for two sounding rocket flights in the dayside auroral zone. At times, effects of dc electric fields parallel to the magnetic field are evident in that: (1) within precipitation features, protons are decelerated by an amount of energy consistent with that which electrons gain and (2) electrons are sometimes aligned to within 3 deg (full width at half maximum) of the magnetic field. A maximum altitude for the accelerating region of several thousand kilometers is deduced from the narrow width of the pitch angle distribution and also from time-of-flight delays between the observation of accelerated electrons and decelerated protons.
Torbert, R. B.↗
Properties of low-energy electron precipitation in the cleft during periods of unusually high ambient electron temperatures
A recently developed automated fitting procedure for Dynamics Explorer 2 electron energy spectra represents each auroral electron spectrum as a superposition of several Maxwellian and several Gaussian components. The fitting parameters give a digital representation which uniquely describes each spectrum. It is shown that unusually high ambient electron temperatures (of the order of 10,000 K) in the cleft are strongly correlated with the intensity parameters of the lowest-temperature Maxwellian components of the precipitation. The collisional heat input into the ambient electrons by these Maxwellian components of the precipitation fluxes is shown to be more than an order of magnitude higher in the high-temperature storm time cases than it is in a control set of 'normal temperature' quiet time cases. The heating effect of the solar flux is shown to be nearly the same for both sets of cases. As a result it is concluded that electron precipitation is the chief mechanism responsible for those high ambient temperatures.
Fontheim, Ernest G.↗
Energy spectra of plasma sheet ions and electrons from about 50 eV/e to about 1 MeV during plamsa temperature transitions
ISEE-1 charged-particle measurements obtained during eight plasma temperature transitions (PTTs) in 1978-1979 are compiled in tables and graphs and analyzed in detail, comparing the ion and electron differential energy spectra with the predictions of theoretical models. PTTs are defined as approximately 1-h periods of low bulk plasma velocity and steadily increasing or decreasing thermal energy. A Maxwellian distribution is found to be inadequate in describing the PTT energy spectra, but velocity-exponential and kappa distributions are both successful, the latter especially at higher energies. The power-law index kappa varies from PTT to PTT, but the high-energy spectral index and overall shape of the distribution remain constant during a PTT; both spatial and temporal effects are observed.
Christon, S. P.↗
Meduim-Resolution Studies of Extreme Ultraviolet Emission from CO by Electron Impact
We report medium resolution electron-impact induced emission spectra of CO for 20, 100 1nd 200 eV impact energies.
blended components↗
Unified Description of Cuprate Superconductors by Fractionalized Electrons Emerging from Integrated Analyses of Photoemission Spectra and Quasiparticle Interference
Electronic structure of high-temperature superconducting cuprates is studied by analyzing experimental data independently obtained from two complementary spectroscopies: one, quasiparticle interference (QPI) measured by scanning-tunneling microscopy, and the other, angle-resolved photoemission spectroscopy (ARPES). We combine these two sets of data in a unified theoretical analysis. Through explicit calculations of experimentally measurable quantities, we show that a simple two-component fermion model (TCFM) representing electron fractionalization succeeds in reproducing various detailed features of these experimental data: ARPES and QPI data are concomitantly reproduced by the TCFM in full energy and momentum spaces. The measured QPI pattern reveals a signature characteristic of the TCFM, distinct from the conventional single-component prediction, supporting the validity of the electron fractionalization in the cuprates. The integrated analysis also solves the puzzles of ARPES and QPI data that are seemingly inconsistent with each other. The overall success of the TCFM offers a comprehensive understanding of the electronic structure of the cuprates, in particular, the unoccupied side of the spectra, of which momentum-resolved structure has long been unexplored experimentally. We further predict that a characteristic QPI pattern should appear in the unoccupied high-energy part if the fractionalization is at work. We propose that integrated-spectroscopy analyses offer a promising way to explore challenging issues of strongly correlated electron systems.
Sakai, Shiro [Sophia University; RIKEN Center for ↗