Chemistry Commons^™

2002 & 2003 Annual Meeting Extended Abstracts

Journal of the South Carolina Academy of Science

No abstract provided.

South Carolina Statewide Science Safety Project., Linda Sinclair, Jack Gerlovich, Rahul A. Parsa

Journal of the South Carolina Academy of Science

No abstract provided.

Some Notes On Multiplicative Congruential Random Number Generators With Mersenne Prime Modulus 261-1., James Harris

Journal of the South Carolina Academy of Science

No abstract provided.

Maternal And Sibling Influences On Seed Germination Of Aegilops Triuncialis Erin, Erin Scott, Andrew R. Dyer

Journal of the South Carolina Academy of Science

No abstract provided.

Scas Officers And Council Members 2003 - 2004

Journal of the South Carolina Academy of Science

No abstract provided.

Critical Thinking And Biology Instruction., David J. Stroup, John L. Frola

Journal of the South Carolina Academy of Science

No abstract provided.

Low-Flow Helmholtz Resonator For Molar Mass Detection, Brackman Amy, Amanda Kea, Kenneth Mcgill

The Corinthian

A simple apparatus was constructed for an undergraduate physical chemistry laboratory to determine a mathematical model of wavelike motion. The apparatus was assembled by attaching an airflow valve connected to a tank of argon gas to a GC column, thus creating regulated airflow. The air was manipulated to gently flow over a small sensitive microphone that was attached to an inexpensive resonator. A model will be developed to measure the speed of sound that will lead to the measurement of the molar mass.

Comparison Between The Ultraviolet Emission From Pulsed Microhollow Cathode Discharges In Xenon And Argon, Isfried Petzenhauser, Leopold D. Biborosch, Uwe Ernst, Klaus Frank, Karl H. Schoenbach

Bioelectrics Publications

We measured the dynamic I–V characteristics and vacuum ultraviolet (VUV) emission lines of the second continuum in xenon (170 nm) and argon (130.5 nm) from pulsed microhollow cathode discharges (MHCD). For pulse lengths between 1 and 100 μs the dynamic I–V characteristics are similar in both inert gases. Only the time variation of the VUV emission line at 170 nm for xenon can be related to the dimer excited states. In argon the energy transfer between the Ar*₂ dimers and the oxygen impurity atoms is responsible for a qualitatively different time behavior of the resonance line at 130.5 nm. …

Corrosion Of Steel By Lead Bismuth Eutectic, John Farley, Allen L. Johnson, Dale L. Perry

Transmutation Sciences Materials (TRP)

Materials for transmuter systems must be able to tolerate high neutron fluxes, great temperatures, and chemical corrosion. For lead bismuth eutectic (LBE) systems, there is an additional challenge in that the corrosive behaviors of materials in LBE are not well understood. Most of the available information on LBE systems has come from the Russians, who have over 80 reactor-years experience with LBE coolant in their Alpha-class submarine reactors. The Russians found that the presence of small amounts of oxygen (on the order of parts per million) in the LBE significantly reduced corrosion. However, a fundamental understanding and verification of its …

Surface Studies Of Corrosion Of Stainless Steel By Lead Bismuth Eutectic, Daniel Koury, Brian D. Hosterman, John Farley, Dale L. Perry, D. Parsons, J. Manzerova, Allen L. Johnson

Transmutation Sciences Materials (TRP)

Why is Lead Bismuth Eutectic Important?

• Changing national security stances have led to reexamination of nuclear waste reprocessing

• Dangerous actinides can be separated and

• Transmuted into safer products, creating a waste form dangerous for only hundreds of years, in addition to the production (up to 1/3 of the original fission energy) of useful energy

• Non-moderating coolants or spallation targets for production of fast neutrons is required for transmutation

• Russian experience with LBE coolants in their nuclear submarine fleet makes LBE an attractive possible transmutation coolant technology

• Corrosion of steel by LBE is an important …

Nuclear Criticality, Shielding, And Thermal Analyses Of Separations Processes For The Transmutation Fuel Cycle, William Culbreth, Denis Beller

Separations Campaign (TRP)

The first step in any transmutation strategy is the separation of radionuclides in used nuclear fuel. The current separation strategy supporting the Advanced Fuel Cycle Initiative (AFCI) program is based on the use of a solvent extraction separation process to separate the actinides, fission products, and uranium from used commercial nuclear fuel, and on the use of pyrochemical separation technologies to process used transmuter fuels. To separate the fission products and transuranic elements from the uranium in used fuel, the national program is developing a new solvent extraction process, the Uranium Extraction Plus, or UREX+, process, based on the traditional …

Investigation Of The Corrosion Of Steel By Lead-Bismuth Eutectic (Lbe) Using Scanning Electron Microscopy And X-Ray Photoelectron Spectroscopy, Daniel Koury

UNLV Theses, Dissertations, Professional Papers, and Capstones

Lead Bismuth Eutectic (LBE) has been proposed for use in programs for accelerator transmutation of waste. LBE is the leading candidate material as a spallation target and an option for the sub-critical blanket coolant. The corrosion of 316 and 316L stainless steels by LBE has been studied using UNLV's facilities for Scanning Electron Microscopy (SEM) and X-ray Photoelectron Spectroscopy (XPS). We have compared exposed and unexposed samples and studied the differences. Some amount of surface contamination is present on the samples and has been removed by ionbeam etching. The unexposed samples reveal typical stainless steel characteristics: a chromium oxide passivation …

Fragmentation Processes Following Core Excitation In Acetylene And Ethylene By Partial Ion Yield Spectroscopy, Maria Novella Piancastelli, Wayne C. Stolte, Gunnar Ohrwall, S-W Yu, D. Bull, K. Lantz, Alfred S. Schlachter, Dennis W. Lindle

Chemistry and Biochemistry Faculty Research

Partial ion yield spectroscopy provides a very detailed picture of fragmentation processes following core excitation in isolated molecules. We exploit this potential in the analysis of decay processes following C1s→π and C1s→Rydberg excitations in ethylene and acetylene. We show that the relative intensity of spectral features related to the excitation to empty molecular orbitals or to Rydberg states is a function of the time variation of the fragmentation process. Namely, we see an intensity increase in the Rydberg states compared to the molecular orbitals as the fragmentation process becomes more extensive, a result attributable to the diffuse nature of the …

Corrosion Of Steel By Lead Bismuth Eutectic: Quarterly Report August September October 2002, John Farley

Transmutation Sciences Materials (TRP)

We continued with sputter depth profiling of 316 and 316L steel samples that have been exposed to LBE. We also calibrated the sputter depth profiling using a sample of SiO₂ on Si, and the SEM. This is a valuable independent determination of the thickness of oxide layers.

In the laboratory, progress continues using the XPS machine. Experiments have been performed on steel samples using Argon ions to mill away the surface of the sample, thereby making measurements as a function of depth. This "ion beam milling" proceeds slowly through the oxide layer that covers the steel sample. We are …

University Of Nevada, Las Vegas Advanced Accelerator Applications University Participation Program: Quarterly Report, Third Quarter Year 2 (Sept. 2002 To Nov. 2002), Anthony Hechanova

Transmutation Research Program Reports (TRP)

This Quarterly Report is a primary deliverable from the University of Nevada, Las Vegas (UNLV) Advanced Accelerator Applications (AAA) University Participation Program (UPP) Director to the U.S. Department of Energy (DOE) as described in the UNLV AAA proposal and Statement of Work for the Fourth Quarter.

The UNLV AAA UPP Director implements the program’s administration using staff from the Harry Reid Center for Environmental Studies (HRC) to ensure that work conducted under the UNLV AAA UPP meets program objectives. The UNLV AAA program consists of three components: Program Support, Research Infrastructure Augmentation, and Student Research.

Monte Carlo Simulation On The Indirect Exchange Interactions Of Co-Doped Zno Film, Abraham F. Jalbout, Hanning Chen, Scott L. Whittenburg

Chemistry and Biochemistry Faculty Publications

Monte Carlo simulations using a three-dimensional lattice model studied the Ruderman–Kittel–Kasuya–Yosida (RKKY) indirect exchange interaction of doped magnetic Co ions in ZnOfilms. The results of the calculations show that the RKKY interaction in Co-doped ZnO is long ranged and its magnitude is proportional to (inverse of the distance from a central ion). The sign oscillates with a frequency that depends on the concentration of the carrier. The long-distance sum of the RKKY indirect exchange energies is positive indicating that these materials are ferromagnetic, in direct correlation with previously reported results.

Holographic Analysis Of Diffraction Structure Factors, S. Marchesini, N. Mannella, C. S. Fadley, M. A. Van Hove, J. J. Bucher, D. K. Shuh, L. Fabris, M. J. Press, M. W. West, Wayne C. Stolte, Z. Hussain

Chemistry and Biochemistry Faculty Research

We combine the theory of inside-source/inside-detector x-ray fluorescence holography and Kossel lines/x ray standing waves in kinematic approximation to directly obtain the phases of the diffraction structure factors. The influence of Kossel lines and standing waves on holography is also discussed. We obtain partial phase determination from experimental data obtaining the sign of the real part of the structure factor for several reciprocal lattice vectors of a vanadium crystal.

Corrosion Of Steel By Lead Bismuth Eutectic: Quarterly Report For May-June-July 2002, John Farley

Transmutation Sciences Materials (TRP)

The goal of this project is to understand the basic science of corrosion in the steel/LBE system.

We are taking more data, typically using the newly installed X-ray Photoelectron Spectrometry (XPS) apparatus, and analyzing our existing data. Undergraduate students Denise Parsons and Julia Manzerova have helped a great deal in the analysis of the data. We can obtain the elemental composition as a function of position within the sample. This gives clues to the migration of materials, the composition of the protective oxide layer, and the basic science of the corrosion process. We found dramatic differences between the exposed and …

44th Rocky Mountain Conference On Analytical Chemistry

Rocky Mountain Conference on Magnetic Resonance

Final program, abstracts, and information about the 44th annual meeting of the Rocky Mountain Conference on Analytical Chemistry, co-endorsed by the Colorado Section of the American Chemical Society and the Society for Applied Spectroscopy. Held in Denver, Colorado, July 28 - August 1, 2002.

In-Situ X-Ray-Absorption Spectroscopy Study Of Hydrogen Absorption By Nickel-Magnesium Thin Films, B. Farangis, Ponnusamy Nachimuthu, T. J. Richardson, J. L. Slack, Rupert C. Perera, Eric M. Gullikson, Dennis W. Lindle, M. Rubin

Chemistry and Biochemistry Faculty Research

Structural and electronic properties of co-sputtered Ni-Mg thin films with varying Ni to Mg ratio were studied by in-situ x-ray absorption spectroscopy in the Ni L-edge and Mg K-edge regions. Co-deposition of the metals led to increased disorder and decreased coordination around Ni and Mg compared to pure metal films. Exposure of the metallic films to hydrogen resulted in formation of hydrides and increased disorder. The presence of hydrogen as a near neighbor around Mg caused a drastic reduction in the intensities of multiple scattering resonances at higher energies. The optical switching behavior and changes in the x-ray spectra varied …

Non-Dipolar Electron Angular Distributions From Fixed-In-Space Molecules, Renaud Guillemin, Oliver Hemmers, Dennis W. Lindle, E. Shigemasa, K. Le Guen, D. Ceolin, C. Miron, N. Leclercq, P. Morin, Marc Simon, P. W. Langhoff

Environmental Studies Faculty Publications

The first indication of nondipole effects in the azimuthal dependence of photoelectron angular distributions emitted from fixed-in-space molecules is demonstrated in N₂. Comparison of the results with angular distributions observed for randomly oriented molecules and theoretical derivations for the nondipole correction first order in photon momentum suggests that higher orders will be needed to describe distributions measured in the molecular frame.

Magnetization Reversal Of Elliptical Co/Cu/Co Pseudo-Spin Valve Dots, Ngocnga Dao, Scott L. Whittenburg, Y. Hao, Leszek M. Malkinski, Jian Qing Wang, C. A. Ross

Chemistry and Biochemistry Faculty Publications

We present our recent simulated results on Cr (5 nm)/ Cu (5 nm)/ Co (5 nm)/ Cu (3 nm)/ Co (2 nm) pseudo-spin valve dots. The simulated results agree qualitatively with the experimental results. Three different sizes of elliptical dots, and were simulated. Our simulations show that in these types of dots magnetization reversal occurs by the formation of domain walls: for and for No domain wall was observed in the reversal of the dots. For such dots, the simulated loops show a small two-step reversal pattern with the thin upper layer partially reversing followed by complete reversal of both …

Magnetic And Mössbauer Studies On Oxygen Deficient Perovskite, La₀.₆Sr₀.₄Feo3-Δ, Jinbo Yang, William B. Yelon, William Joseph James, X.-D. Zhou, Yixiang Xie, Harlan U. Anderson, Zili Chu

Physics Faculty Research & Creative Works

Samples of La_0.6Sr_0.4Fe_3-δ with varying oxygen vacancy contents were prepared by heating them in different gas flows. Magnetization measurement showed that samples with low oxygen vacancies have a magnetic ordering temperature in the range of 300-325 K while those with 9%-12% oxygen vacancies have a magnetic ordering temperature of 800 K and higher. Mössbauer spectra at 300 K exhibit paramagnetic or weak magnetic characteristics for the N₂, O₂, and air-quenched samples, whereas an average hyperfine field of 52 T is found for the CO/CO₂ reduced samples. The heat treatment in …

Magnetic And Neutron Diffraction Studies On Prmnsb₂, Satish K. Malik, Zili Chu, Amish G. Joshi, Jinbo Yang, William B. Yelon, Qingsheng Cai, William Joseph James, Kishore Kamaraju

Physics Faculty Research & Creative Works

Magnetic and neutron diffraction studies have been carried out on PrMnSb₂. Magnetization data in the temperature range of 5-400 K show two magnetic transitions: one at ∼175 K attributed to the antiferromagnetic ordering of the Mn moments, and the other at ∼35 K possibly due to the antiferromagnetic ordering of the Pr moments. The magnetization-field isotherms at various temperatures are consistent with the above. Neutron diffraction data obtained at various temperatures can be fitted with a nearly antiferromagnetically coupled Mn moment of ∼3μ_B at 70 K. At 10 K, moments both on Mn (∼3.5μ_B) and …

Magnetic Properties Of Iron-Rich Mixed Rare-Earth Sm₂-ₓtbₓfe17-YSiY Compounds, Kishore Kamaraju, Jinbo Yang, William B. Yelon, Oran Allan Pringle, William Joseph James, Ph. I'Héritier

Physics Faculty Research & Creative Works

A series of Sm_2-xTb_xFe_17-ySi_y solid solutions with x = 0, 1, and 1.5 and y = 1, 2, and 3 were prepared by induction melting stoichiometric amounts of high purity elements. The x-ray diffraction data confirm that the postannealed samples are 2:17 intermetallics of the R3 space group. The lattice parameters and the unit cell volumes were calculated using a modified Rietveld program. The fitted intensities showed behavior related to a disordered rhombohedral structure as inferred from neutron data. It was observed that for a particular y, the unit cell volume decreased almost …

Observation Of Novel Disordered Rhombohedral R₂Fe₁₇ (R=Rare Earth) Based Compounds, William B. Yelon, William Joseph James, Jinbo Yang, Kishore Kamaraju, Qingsheng Cai, Zili Chu, Satish K. Malik

Physics Faculty Research & Creative Works

A recent study of (SmGd)Fe 14Si₃ showed an anomalous x-ray diffraction pattern [P. C. Ezekwenna, G. K. Marasinghe, J.-H. Nam, W. J. James, W. B. Yelon, M. Ellouze, and Ph. I'Héritier, J. Appl. Phys. 87, 6716 (2000)]. Although all observed peaks could be indexed to the rhombohedral 2:17 phase (R-3m) many lines were strongly reduced in intensity. Subsequently, the same phenomenon was seen in neutron diffraction patterns from Nd_2-xDy_sFe_17-ySi_y alloys and conventional refinement using the rhombohedral phase left significant residuals. Fourier mapping revealed additional density along the c-axis chains of Fe dumbbells …

Possible Ordering Of Ru And Cu In The Charge-Reservoir Of Magneto-Superconductor Rusr₂Gdcu₂O₈ (Ru-1212): Magnetic, Transport, And Tem Microstructural Studies, V. P. S. Awana, S. Ichihara, J. Nakamura, M. Karppinen, H. Yamauchi, Jinbo Yang, William B. Yelon, William Joseph James, Satish K. Malik

Physics Faculty Research & Creative Works

Magnetization vs temperature behavior of RuSr₂GdCu₂O_8-δ (Ru-1212) measured in an field of 5 Oe, shows a clear branching of zero-field-cooled (ZFC) and field-cooled (FC) curves around 140 K, a cusp at 135 K, and a diamagnetic transition around 20 K (in the ZFC branch). The cusp at 135 K is due to the antiferromagnetic ordering of the Ru moments. The magnetization-field isotherms, below 50 K, show a nonlinear contribution from a ferromagnetic component. The resistance vs temperature behavior of the compound, in applied fields of 0, 3, and 7 T, confirms that the sample is …

Structure And Magnetic Properties Of The Mnbi Low Temperature Phase, Jinbo Yang, William B. Yelon, William Joseph James, Qingsheng Cai, Samit Roy, Naushad Ali

Physics Faculty Research & Creative Works

High purity MnBi low temperature phase has been prepared and analyzed using magnetic measurements and neutron diffraction. The low-temperature phase of the MnBi alloy has a coercivity μ_0iH_c of 2.0 T at 400 K, and exhibits a positive temperature coefficient from 0 to at least 400 K. The neutron data refinement indicated that the Mn atom changes its spin direction from c axis above room temperature to nearly perpendicular to the c axis at 50 K. A canted magnetic structure has been observed below 200 K. The anisotropy field increases with increasing temperature which gives rise to …

The Relationship Between Magnetic Interactions And Near Neighbor Interatomic Distances In The Transition Metal Sublattice Of R(Mn/Fe)₆A₆(R=Nd Or Sm, A=Ge Or Sn), G. K. Marasinghe, J. Han, William Joseph James, William B. Yelon, Naushad Ali

Chemistry Faculty Research & Creative Works

The magnetic and crystallographic structures of R(Fe/Mn)₆A₆ (R=Nd or Sm and A = Ge or Sn) intermetallics have been investigated using x-ray and neutron diffraction techniques and superconducting quantum interference device magnetic measurements. For both stannides (A = Sn) and germanides (A = Ge), the lattice contracts with increasing iron content. In the case of the stannides, substitution of manganese by iron enhances the saturation magnetization and Curie temperature at low iron concentrations (x ≤2 ) suggesting the presence of an extremely rare occurrence, positive coupling between iron and manganese magnetic moments. In contrast, the magnetic properties …

Photoexcitation Of A Dipole-Forbidden Resonance In Helium, B. Krassig, E. P. Kanter, S. H. Southworth, Renaud Guillemin, Oliver Hemmers, Dennis W. Lindle, R. Wehlitz, N. L. S. Martin

Environmental Studies Faculty Publications

We have observed photoexcitation of the dipole-forbidden 1s²¹S₀→2p²¹D₂ resonance in helium by measuring the nondipolar forward-backward asymmetry of photoelectron angular distributions in the 2ℓ2ℓ^′ autoionizing region. By exploiting the electric dipole-quadrupole interference in the excitation of both the 2s2p¹P₁ and 2p²¹D₂ levels, we have observed the quadrupole resonance in photoabsorption and extracted its Fano line shape parameters and the relative phase of the 1sEp and 1sEd continua. We find the quadrupole line profile index q₂ to be markedly different from theoretical expectations.