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Full-Text Articles in Physical Sciences and Mathematics

Simulation And Analysis Of Cadmium Sulfide Nanoparticles, Chad Everett Junkermeier Dec 2008

Simulation And Analysis Of Cadmium Sulfide Nanoparticles, Chad Everett Junkermeier

Theses and Dissertations

I used ab initio molecular dynamics calculations to model cadmium sulfide nanoparticles. The nanoparticles were originaly spherical, bulk-like zinc-blende structures. Constant temperature molecular dynamics calculations reveals that CdS nanoparticles that are about 2 nm in diameter and have unpassivated surfaces are in an amorphous structure with short range order. The nearest neighbor distance on the surface of the nanoparticles being near the wurtzite nearest neighbor distance. I wrote the program xyzSTATS and used its results in justifying the amorphous nanoparticles claim. I also estimated the band gap of the CdS nanoparticles with unpassivated dangling bonds.


Antiphase Ordering And Surface Phases In Lithium Aluminate, Richard R. Vanfleet, J. A. Simmons, D. W. Hill, M. M. C. Chou, B. H. Chai Nov 2008

Antiphase Ordering And Surface Phases In Lithium Aluminate, Richard R. Vanfleet, J. A. Simmons, D. W. Hill, M. M. C. Chou, B. H. Chai

Faculty Publications

Antiphase domains are seen in single crystal gamma lithium aluminate (gamma-LiAlO2) with 16.7 nm periodicity in the <110> direction. Alternate domains have a (1/2) [001] shift. Beta phase lithium aluminate (beta-LiAlO2) is seen to form on the surface of the as-received wafers with an epitaxial strain limited relationship with the bulk gamma phase. The orthorhombic beta phase aligns with the a and b axes (0.528 and 0.630 nm) matching with the tetragonal gamma phase's a and c axes (0.5168 and 0.6268 nm). The gamma and beta phases are seen to have different etch rates. The beta phase converts back to the …


Extreme-Ultraviolet Polarimeter Utilizing Laser-Generated High-Order Harmonics, Nicole Brimhall, Matthew Turner, Nicholas Herrick, David D. Allred, R. Steven Turley, Michael Ware, Justin Peatross Oct 2008

Extreme-Ultraviolet Polarimeter Utilizing Laser-Generated High-Order Harmonics, Nicole Brimhall, Matthew Turner, Nicholas Herrick, David D. Allred, R. Steven Turley, Michael Ware, Justin Peatross

Faculty Publications

We describe an extreme-ultraviolet (EUV) polarimeter that employs laser-generated high-order harmonics as the light source. The polarimeter is designed to characterize materials and thin films for use with EUV light. Laser high harmonics are highly directional with easily rotatable linear polarization, not typically available with other EUV sources. The harmonics have good wavelength coverage, potentially spanning the entire EUV from a few to a hundred nanometers. Our instrument is configured to measure reflectances from 14 to 30 nm and has ~180 spectral resolution (lambda/delta lambda). The reflection from a sample surface can be measured over a continuous range of incident …


Testing Direct Simulation Monte Carlo Methods Against The Fluid Equations In The Inductively Coupled Plasma Mass Spectrometer, William R. Somers Aug 2008

Testing Direct Simulation Monte Carlo Methods Against The Fluid Equations In The Inductively Coupled Plasma Mass Spectrometer, William R. Somers

Theses and Dissertations

A Direct Simulation Monte Carlo fluid dynamics code named FENIX has been employed to study gas flow-through properties of the inductively coupled plasma mass spectrometer (ICP-MS). Simulation data have been tested against the Navier-Stokes and heat equations in order to see if FENIX functions properly. The Navier-Stokes and heat equations have been constructed from simulation data and are compared term by term. This comparison shows that FENIX is able to correctly reproduce fluid dynamics throughout the ICP-MS simulation, with an exception immediately behind the ICP-MS sampler cone, where the continuum criterion for the Navier-Stokes equation is not met. Testing the …


Implementation Of Optical Spectra Calculations In Fireball: A Local-Orbital Density Functional Theory Approach, Ivan Grigoryevich Okhrimenko Aug 2008

Implementation Of Optical Spectra Calculations In Fireball: A Local-Orbital Density Functional Theory Approach, Ivan Grigoryevich Okhrimenko

Theses and Dissertations

We have expanded the capabilities of the ab initio tight-binding molecular dynamics package FIREBALL to include calculations of optical properties. Basic zero order approximation is based on transitions between Kohn-Sham states. Corrections for electron-electron interactions are based on time dependant density functional theory (TDDFT). Consistent with the FIREBALL approach, we use precalculated integrals and approximations to make the program faster.


Recombination Fluorescence In Ultracold Neutral Plasmas, Scott D. Bergeson, F. Robicheaux Aug 2008

Recombination Fluorescence In Ultracold Neutral Plasmas, Scott D. Bergeson, F. Robicheaux

Faculty Publications

We present the first measurements and simulations of recombination fluorescence from ultracold neutral calcium plasmas. This method probes three-body recombination at times less than 1 µs, shorter than previously published time scales. For the lowest initial electron temperatures, the recombination rate scales with the density as n22, significantly slower than the predicted n3. Recombination fluorescence opens a new diagnostic window in ultracold plasmas. In most cases it probes deeply bound level populations that depend critically on electron energetics. However, a perturbation in the calcium 4snd Rydberg series allows our fluorescence measurements to probe the population in weakly bound levels that …


Theory And Estimation Of Acoustic Intensity And Energy Density, Derek C. Thomas Jul 2008

Theory And Estimation Of Acoustic Intensity And Energy Density, Derek C. Thomas

Theses and Dissertations

In order to facilitate the acquisition and accurate interpretation of intensity and energy density data in high-amplitude pressure fields, the expressions for intensity and energy density are examined to ascertain the impact of nonlinear processes on the standard expressions. Measurement techniques for estimating acoustic particle velocity are presented. The finite-difference method is developed in an alternate manner and presented along with bias and confidence estimates. Additionally, two new methods for estimating the local particle velocity are presented. These methods appears to eliminate the errors and bias associated with the finite-difference technique for certain cases.


An Ultrahigh Stability, Low-Noise Laser Current Driver With Digital Control, Christopher J. Erickson, Marshall Van Zijll, Greg Doermann, Dallin S. Durfee Jul 2008

An Ultrahigh Stability, Low-Noise Laser Current Driver With Digital Control, Christopher J. Erickson, Marshall Van Zijll, Greg Doermann, Dallin S. Durfee

Faculty Publications

We present a low-noise, high modulation-bandwidth design for a laser current driver with excellent long-term stability. The driver improves upon the commonly used Hall–Libbrecht design. The current driver can be operated remotely by way of a microprocessing unit, which controls the current set point digitally. This allows precise repeatability and improved accuracy and stability. It also allows the driver to be placed near the laser for reduced noise and for lower phase lag when using the modulation input. We present the theory of operation for our driver in detail, and give a thorough characterization of its stability, noise, set-point accuracy …


Early Dynamics Of Ultracold Neutral Plasmas, Adam W. Denning Jul 2008

Early Dynamics Of Ultracold Neutral Plasmas, Adam W. Denning

Theses and Dissertations

We report new studies on the early-time dynamics of ultracold neutral plasmas. We use fluorescence spectroscopy to probe plasma dynamics on the nanosecond time scale. We determine the rms ion velocity during the initial plasma period. The initial ion acceleration is found as the time derivative of the ion velocity. We compare to a theoretical model. The experimental results agree with the model at low plasma densities. However, the ion acceleration is a factor of ten lower than the model at higher densities. The cause of this discrepancy is currently unknown.


Algorithm For Generating Derivative Structures, Gus L. W. Hart, Rodney W. Forcade Jun 2008

Algorithm For Generating Derivative Structures, Gus L. W. Hart, Rodney W. Forcade

Faculty Publications

We present an algorithm for generating all derivative superstructures--for arbitrary parent structures and for any number of atom types. This algorithm enumerates superlattices and atomic configurations in a geometry-independent way. The key concept is to use the quotient group associated with each superlattice to determine all unique atomic configurations. The run time of the algorithm scales linearly with the number of unique structures found.


The Enigmatic Young Object: Walker 90/V590 Monocerotis, M. D. Joner, M. R. Perez, B. Mccollum, M. E. Van Dend Ancker May 2008

The Enigmatic Young Object: Walker 90/V590 Monocerotis, M. D. Joner, M. R. Perez, B. Mccollum, M. E. Van Dend Ancker

Faculty Publications

Aims. We assess the evolutionary status of the intriguing object Walker 90/V590 Mon, which is located about 20 arcmin northwest of the Cone Nebula near the center of the open cluster NGC 2264. This object, according to its most recent optical spectral type determination (B7), which we confirmed, is at least 3 mag too faint in V for the cluster distance, but it shows the classical signs of a young pre-main sequence object, such as highly variable H emission, Mg II emission, IR excess, UV continuum, and optical variability. Methods. We analyzed a collection of archival and original data on …


On The Steering Of Sound Energy Through A Supercritical Plate By A Near-Field Transducer Array, Brian E. Anderson, Stephen A. Hambric, Jack W. Hughes May 2008

On The Steering Of Sound Energy Through A Supercritical Plate By A Near-Field Transducer Array, Brian E. Anderson, Stephen A. Hambric, Jack W. Hughes

Faculty Publications

The ability to direct sound energy through the flexural vibrations of a submerged plate at various angles of incidence using a near-field transducer array is investigated. An alumina bar is placed in front of a one-dimensional, eight-element transducer array, between the array and the water. Operating in a receive mode, data were taken as a function of angle of incidence and compared to data taken without the presence of the alumina bar. The array was also operated in transmit mode and results were compared to corresponding receive mode data, showing that reciprocity holds. Results show that in fact sound energy …


Metallicity And Effective Temperature Of The Secondary Or Rs Ophicuhi, R. L. Pearson Iii, Ya. V. Pavlenko, A. Evans, T. Kerr, L. Yakovina, C. E. Woodward, D. Lynch, R. Rudy, R. W. Russell Apr 2008

Metallicity And Effective Temperature Of The Secondary Or Rs Ophicuhi, R. L. Pearson Iii, Ya. V. Pavlenko, A. Evans, T. Kerr, L. Yakovina, C. E. Woodward, D. Lynch, R. Rudy, R. W. Russell

Faculty Publications

Context. The recurrent nova RS Ophiuchi undergoes nova eruptions every 10-20 years as a result of thermonuclear runaway on the surface of a white dwarf close to the Chandrasekhar limit. Both the progress of the eruption and its aftermath depend on the (poorly known) composition of the red giant in the RS Oph system. Aims. Our aim is to understand better the effect of the giant secondary on the recurrent nova eruption. Methods. Synthetic spectra were computed for a grid of M-giant model atmospheres having a range of effective temperatures 3200 < Teff < 4400 K, gravities 0 < log g < 1 and abundances -4 < [Fe/H] < 0.5, and fit to infrared spectra of RS Oph as it returned to quiescence after its 2006 eruption. We have modelled the infrared spectrum in the range 1.4-2.5µm to determine metallicity and effective temperature of the red giant. Results. We find Teff= 4100 ±100 K, log g = 0.0 ±0.5, [Fe/H] = 0.0 ±0.5, [C/H] = -0.8 ±0.2, [N/H] = +0.6 ±0.3 in the atmosphere of the secondary, and demonstrate that inclusion of some dust "veiling" in the spectra cannot improve our fits.


Error Sensor Strategies For Active Noise Control And Active Acoustic Equalization In A Free Field, Ryan T. Chester Mar 2008

Error Sensor Strategies For Active Noise Control And Active Acoustic Equalization In A Free Field, Ryan T. Chester

Theses and Dissertations

Several measurements may be used as error signals to determine how to appropriately control a sound field. These include pressure, particle velocity, energy density and intensity. In this thesis, numerical models are used to show which signals perform best in is free-field active noise control (ANC) using error sensors located in the near field of the sound sources. The second is equalization in a free field and a semi-free field. Minimized energy density total power output (MEDToPO) plots are developed; these indicate the maximum achievable attenuation for a chosen error sensor as a function of location. A global listening area …


Improving Performance Of The Filtered-X Least Mean Square Algorithm For Active Control Of Noise Contatining Multiple Quasi-Stationary Tones, Stephan P. Lovstedt Mar 2008

Improving Performance Of The Filtered-X Least Mean Square Algorithm For Active Control Of Noise Contatining Multiple Quasi-Stationary Tones, Stephan P. Lovstedt

Theses and Dissertations

The Filtered-X Least-Mean-Square (FXLMS) algorithm is widely used in active noise control due to its robustness, simplicity, and ability to be implemented in real time. In a feedforward implementation of the FXLMS algorithm, a reference signal that is highly correlated with the noise to be controlled is filtered with an estimate of the transfer function of the secondary path. The convergence characteristics of the FXLMS algorithm have been well studied. A convergence parameter is used to optimize the convergence of the algorithm. However, the optimal value for the convergence parameter is frequency dependent. Thus for noise containing multiple tones at …


Clouds Search For Variability In Brown Dwarf Atmospheres: Infrared Spectroscopic Time Series Of L/T Transition Brown Dwarfs, D. Stephens, B. Goldman, M. C. Cushing, M. S. Marley, E. Artigau, K. S. Baliyan, V. J. S. Bejar, J. A. Caballero, N. Chanover, M. Connelley, R. Doyon, T. Forveille, S. Ganesh, C. R. Gelino, H. B. Hammel, J. Holtzman, S. Joshi, U. C. Joshi, S. K. Leggett, M. C. Liu Feb 2008

Clouds Search For Variability In Brown Dwarf Atmospheres: Infrared Spectroscopic Time Series Of L/T Transition Brown Dwarfs, D. Stephens, B. Goldman, M. C. Cushing, M. S. Marley, E. Artigau, K. S. Baliyan, V. J. S. Bejar, J. A. Caballero, N. Chanover, M. Connelley, R. Doyon, T. Forveille, S. Ganesh, C. R. Gelino, H. B. Hammel, J. Holtzman, S. Joshi, U. C. Joshi, S. K. Leggett, M. C. Liu

Faculty Publications

L-type ultra-cool dwarfs and brown dwarfs have cloudy atmospheres that could host weather-like phenomena. The detection of photometric or spectral variability would provide insight into unresolved atmospheric heterogeneities, such as holes in a global cloud deck. Indeed, a number of ultra-cool dwarfs have been reported to vary. Additional time-resolved spectral observations of brown dwarfs offer the opportunity for further constraining and characterising atmospheric variability. Aims. It has been proposed that growth of heterogeneities in the global cloud deck may account for the L- to T-type transition when brown dwarf photospheres evolve from cloudy to clear conditions. Such a mechanism is …


Time Reversal, Brian E. Anderson, Michele Griffa, Paul A. Johnson, Carene Larmat, Timothy J. Ulrich Jan 2008

Time Reversal, Brian E. Anderson, Michele Griffa, Paul A. Johnson, Carene Larmat, Timothy J. Ulrich

Faculty Publications

This article provides an historical overview of Time Reversal (TR), introduces its basic physics, addresses advantages and limitations, and describes some applications of this very active research area of acoustics. In the Geophysics Group at the Los Alamos National Laboratory, we conduct studies of TR of elastic waves in solids. Our work includes application of TR to nondestructive evaluation of materials, as well as to earthquake source characterization, and ground-based nuclear explosion monitoring. We emphasize the term elastic waves here to underscore that we include both compression and shear waves, in contrast to purely acoustic waves that are only compressional.


Determining The Refractive Index In The Extreme Ultraviolet Using Kramers-Kronig On Thin-Film Scandium Oxide Transmission Data, David D. Allred, Jacqualine J. Butterfield Jan 2008

Determining The Refractive Index In The Extreme Ultraviolet Using Kramers-Kronig On Thin-Film Scandium Oxide Transmission Data, David D. Allred, Jacqualine J. Butterfield

Faculty Publications

Whereas the real part of the refractive index is dependent on both transmittance and reflectance, the imaginary part can be determined from transmittance data alone. It is possible to use Kramers-Kronig analysis to calculate the real part if the imaginary part is known over a sufficiently broad range. We show that the delta calculated from reflection and transmission data without taking into account roughness may underestimate the real part of the refractive index of the scandium oxide samples we are studying by up to 40% near 270 eV.


Nanoscale Characterization Of Thin Film Coatings Using Annular Dark Field Scanning Transmission Electron Microscopy, Guillermo Acosta, Richard Vanfleet, David D. Allred Jan 2008

Nanoscale Characterization Of Thin Film Coatings Using Annular Dark Field Scanning Transmission Electron Microscopy, Guillermo Acosta, Richard Vanfleet, David D. Allred

Faculty Publications

When considering the optical performance of thin films in the Extreme Ultraviolet (EUV), developing an accurate physical description of a thin film coating is necessary to be able to successfully model optical performance. With the short wavelengths of the EUV, film interfaces and sample roughness warrant special attention and care. The surfaces of thin film samples are routinely measured by Atomic Force Microscopy, from which roughness can be determined. However, characterizing the quality of interfaces below the surface is much more challenging. In a recent study of scandium oxide thin films, High Resolution Transmission Electron Microscopy and Annular Dark Field …