Previous X-ray Diffraction (XRD) and Nuclear Magnetic Resonance (NMR) studies on Ti-doped NaAlH{sub 4} revealed the reaction products of two heavily doped (33.3 at.%) samples that were solvent-mixed and mechanically-milled. This investigation revealed that nano-crystalline or amorphous Al{sub 2}O{sub 3} forms from the possible coordination of aluminum with oxygen atom of the furan ring system from added tetrahydrofuran (THF) in the solvent-mixed sample, and that TiAl{sub 3} forms in mechanically-milled samples. The present paper provides a more sophisticated NMR investigation of the these materials. On heavily doped (33.3 at.%) solvent-mixed samples, {sup 27}Al Magic Angle Spinning (MAS) NMR {sup 27}Al multiple quantum MAS (MQMAS) indicates the presence of an oxide layer of Al{sub 2}O{sub 3} on the surfaces of potentially bulk nanocrystalline Ti, nanocrystalline TiAl{sub 3}, and/or metallic aluminum. The {sup 1}H MAS NMR data also indicate the possible coordination of aluminum with the oxygen atom in the THF. On heavily doped samples that were mechanically milled, {sup 27}Al MAS NMR and static NMR confirms the presence of TiAl{sub 3}. In addition, the {sup 1}H MAS NMR and {sup 1}H spin-lattice relaxation (T{sub 1}) measurements are consistent with the presence of TiH{sub 2}. These results are in agreement with recent …

The 3081/E is a second generation emulator of a mainframe IBM. One of it's applications will be to form part of the data acquisition system of the upgraded Mark II detector for data taking at the SLAC linear collider. Since the processor does not have direct connections to I/O devices a FASTBUS interface will be provided to allow communication with both SLAC Scanner Processors (which are responsible for the accumulation of data at a crate level) and the experiment's VAX 8600 mainframe. The 3081/E's will supply a significant amount of on-line computing power to the experiment (a single 3081/E is equivalent to 4 to 5 VAX 11/780's). A major advantage of the 3081/E is that program development can be done on an IBM mainframe (such as the one used for off-line analysis) which gives the programmer access to a full range of debugging tools. The processor's performance can be continually monitored by comparison of the results obtained using it to those given when the same program is run on an IBM computer. 9 refs.

Program booklet for the 30th Actinide Separations Conference. Contains agenda and abstracts for 27 poster and 38 oral presentations to be made during the 3-day meeting, May 23-25, 2006.

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Smoothing of contact surfaces can be used to eliminate the chatter typically seen with node on facet contact and give a better representation of the actual contact surface. The latter affect is well demonstrated for problems with interference fits. In this work we present two methods for the smoothing of contact surfaces for 3D finite element contact. In the first method, we employ Gregory patches to smooth the faceted surface in a node on facet implementation. In the second method, we employ a Bezier interpolation of the faceted surface in a mortar method implementation of contact. As is well known, node on facet approaches can exhibit locking due to the failure of the Babuska-Brezzi condition and in some instances fail the patch test. The mortar method implementation is stable and provides optimal convergence in the energy of error. In the this work we demonstrate the superiority of the smoothed versus the non-smoothed node on facet implementations. We also show where the node on facet method fails and some results from the smoothed mortar method implementation.

Geo-BILT (Geothermal Borehole Induction Logging Tool) is an extended induction logging tool designed for 3D resistivity imaging around a single borehole. The tool was developed for deployment in high temperature geothermal wells under a joint program funded by the California Energy Commission, Electromagnetic Instruments (EMI) and the U.S. Department of Energy. EM1 was responsible for tool design and manufacture, and numerical modeling efforts were being addressed at Lawrence Livermore Laboratory (LLNL) and other contractors. The field deployment was done by EM1 and LLNL. The tool operates at frequencies from 2 to 42 kHz, and its design features a series of three-component magnetic sensors offset at 2 and 5 meters from a three-component magnetic source. The combined package makes it possible to do 3D resistivity imaging, deep into the formation, from a single well. The manufacture and testing of the tool was completed in spring of 2001, and the initial deployment of Geo-BILT occurred in May 2001 at the Lost Hills oil field in southern California at leases operated by Chevron USA. This site was chosen for the initial field test because of the favorable geological conditions and the availability of a number of wells suitable for tool deployment. The second …

An 8-m-long 4-vane radio frequency quadrupole (RFQ) has been proposed by LANL for use in high-current proton accelerators. This RFQ is made up of four 2-m-long coupled segments; the end regions and segment joints need full 3D modeling. In this paper, the strategies for piecewise treatment of the RFQ and results of the modeling are presented.

The volumetrically nonuniform power deposition of the incident 33 GeV electron beam in the SLC Positron Source Target is hypothesized to be the most likely cause target failure. The resultant pulsed temperature distributions are known to generate complicated stress fields with no known closed-form analytical solution. 3D finite element analyses of these temperature distributions and associated thermal stress fields in the new High Power Target are described here. Operational guidelines based on the results of these analyses combined with assumptions made about the fatigue characteristics of the exotic target material are proposed. 6 refs., 4 figs.

In this paper we report on IMPACT-T, a 3D beam dynamics code for modeling high brightness beams in photoinjectors and rf linacs. IMPACT-T is one of the few codes used in the photoinjector community that has a parallel implementation, making it very useful for high statistics simulations of beam halos and beam diagnostics. It has a comprehensive set of beamline elements, and furthermore allows arbitrary overlap of their fields. It is unique in its use of space-charge solvers based on an integrated Green function to efficiently and accurately treat beams with large aspect ratio, and a shifted Green function to efficiently treat image charge effects of a cathode. It is also unique in its inclusion of energy binning in the space-charge calculation to model beams with large energy spread. Together, all these features make IMPACT-T a powerful and versatile tool for modeling beams in photoinjectors and other systems. In this paper we describe the code features and present results of IMPACT-T simulations of the LCLS photoinjectors. We also include a comparison of IMPACT-T and PARMELA results.

The development of a high current, heavy-ion beam for inertial confinement fusion requires a detailed understanding of the behavior of the beam, including effects of the large self-fields. This necessity makes particle-in-cell (PIC) simulation the appropriate tool, and for this reason, the three-dimensional PIC/accelerator code WARP3d is being developed. WARP3d has been used extensively to study the creation and propagation of ion beams both to support experiments and for the understanding of basic beam physics. An overview of the structure of the code is presented along with a discussion of features that make the code an effective tool in the understanding of space-charge dominated beam behavior. A number of applications where WARP3d has played an important role is discussed, emphasizing the need of three-dimensional, first principles simulations. Results and comparisons with experiment are presented.

The accumulator ring of the Spallation Neutron Source (SNS) at ORNL employs in its straight sections closely packed quadrupole doublemagnets with large aperture of R=15.1 cm an relatively short iron-to-iron distance of 51.4 cm. These quads have much extended fringe field, and magnetic interferences among them in the doublet assemblies is not avoidable. Though each magnet in the assemblies has been individually mapped to high accuracy of lower than 0.01 percent level, the experimental data including the magnetic interference effect will not be available. We have performed 3D computing simulations on a quadrupole doublet model in order to assess the degree of the interference and to obtain relevant data for the SNS commissioning and operation.

The 56 MHz SRF Quarter-Wave Resonator (QWR) is designed for RHIC as a storage cavity to improve the collider performance. 2D multipacting simulation has been done for the cavity alone. Ripples were added to the outer body of the cavity for multipacting suppression based on the simulation findings. During operation, there will be four higher order mode (HOM) couplers. All of these components will be exposed to high RF fields. In this paper we compare 2D and 3D codes simulation results for multipacting in the cavity. We also report 3D simulation results for multipacting simulation at the couplers.

The Relativistic Heavy Ion Collider (RHIC) contributes fundamental advances to nuclear physics by colliding a wide range of ions. A novel electron cooling section, which is a key component of the proposed luminosity upgrade for RHIC, requires the acceleration of high-charge electron bunches with low emittance and energy spread. A promising candidate for the electron source is the recently developed concept of a high quantum efficiency photoinjector with a diamond amplifier. To assist in the development of such an electron source, we have implemented algorithms within the VORPAL particle-in-cell framework for modeling secondary electron and hole generation, and for charge transport in diamond. The algorithms include elastic, phonon, and impurity scattering processes over a wide range of charge carrier energies. Results from simulations using the implemented capabilities will be presented and discussed.

The authors describe a numerical scheme to solve 3D Arbitrary Lagrangian-Eulerian (ALE) hydrodynamics on an unstructured mesh using a discontinuous Galerkin method (DGM) and an explicit Runge-Kutta time discretization. Upwinding is achieved through Roe's linearized Riemann solver with the Harten-Hyman entropy fix. For stabilization, a 3D quadratic programming generalization of van Leer's 1D minmod slope limiter is used along with a Lapidus type artificial viscosity. This DGM scheme has been tested on a variety of hydrodynamic test problems and appears to be robust making it the basis for the integrated 3D inertial confinement fusion modeling code (ICF3D). For efficient code development, they use C++ object oriented programming to easily separate the complexities of an unstructured mesh from the basic physics modules. ICF3D is fully parallelized using domain decomposition and the MPI message passing library. It is fully portable. It runs on uniprocessor workstations and massively parallel platforms with distributed and shared memory.

Project status of the 3He{sup +}{sup +} 10.5 MeV RFQ Linear Accelerator for the production of PET isotopes will be presented. The accelerator design was begun in September of 1995 with a goal of completion and delivery of the accelerator to BRF in Shreveport, Louisiana by the summer of 1997. The design effort and construction is concentrated in Lab G on the Fermilab campus. Some of the high lights include a 25 mA peak current 3He` ion source, four RFQ accelerating stages that are powered by surplus Fermilab linac RF stations, a gas jet charge doubler, and a novel 540 degree bending Medium Energy Beam Transport (MEBT). The machine is designed to operate at 360 Hz repetition rate with a 2.5% duty cycle. The average beam current is expected to be 150-300 micro amperes electrical, 75- 150 micro amperes particle current.

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In this paper, we present an 800 MHz crab cavity conceptual design for the LHC upgrade. The cell shape is optimized for lower maximum peak surface fields as well as higher transverse R/Q. A compact coax-to-coax coupler scheme is proposed to damp the LOM/SOM modes. A two-stub antenna with a notch filter is used as the HOM coupler to damp the HOM modes in the horizontal plane and rejects the operating mode at 800MHz. Multipacting (MP) simulations show that there are strong MP particles at the disks. Adding grooves along the short axis without changing the operating mode's RF characteristics can suppress the MP activities. Possible input coupler configurations are discussed.

This paper describes very generally the modulator/regulator (Mod/Reg) being built for Transrex by Systems, Science and Software for use on the neutral beam power supplies that Transrex is building for General Atomic Company to power the neutral beam heating systems that will be used on the Doublet III fusion device. The Mod/Reg is required to provide an 80 kV, 100 A pulse for a second every 90 sec. The voltage is to be regulated to 3%, and in case of fault the pulse must be interrupted within 10 ..mu..sec. An additional requirement was that the total system have very low capacity such that the total energy stored would be less than 15 joules. This is a restriction imposed by the source designer to prevent destroying the source in case of an arc within the source.

Results from the 9975 shipping package Storage and Surveillance Program at the Savannah River Site (SRS) are summarized for justification to extend the life of the 9975 packages currently stored in the K-Area Complex (KAC). This justification is established with the stipulation that surveillance activities will continue throughout the extended time to ensure the continued integrity of the 9975 materials of construction and to further understand the currently identified degradation mechanisms. The 10 year storage life justification was developed prior to storage. A subsequent report was later used to validate the qualification of the 9975 shipping packages for 10 years in storage. However the qualification for the storage period was provided by the monitoring requirements of the 9975 Storage and Surveillance Program. This report summarizes efforts to determine a new safe storage limit for the 9975 shipping package based on the surveillance data collected since 2005 when the 9975 Storage and Surveillance Program began. The Program has demonstrated that the 9975 package has a robust design that can perform under a variety of conditions. The primary emphasis of the on-going 9975 Storage and Surveillance Program is an aging study of the 9975 Viton{reg_sign} containment vessel O-rings and the Celotex{reg_sign} fiberboard …

The inherent brittleness of the A15 compounds, and the requirement for a filamentary morphology, led to a heavy reliance on a powder approach for the preparation of superconducting tapes and wires. The quench-age technique, a non-powder process, was employed for the niobium-aluminum system, following the special features of the equilibrium phase diagram. The powder approach proved particularly effective for binaries, such as Nb-Sn, and for the ternaries Nb(Al,Ge) and Nb(Al,Si). Two variations of the powder process were assessed. One involved the use of precompounded powder of the desired stoichiometry but required simultaneous application of heat and pressure. The second variation was the infiltration process. This process involves the preparation of a ductile niobium matrix containing a controlled network of interconnected pores which are subsequently infiltrated with liquid metals (Sn) or low melting-point eutectics (e.g., Al-Ge, Al-Si). The composite is then subjected to a thermomechanical treatment to form a multiply connected array of A15 filaments in a niobium matrix. Multifilamentary conductors, based on Nb/sub 3/Sn, Nb/sub 3/Al, Nb/sub 3/ (Al,Ge) and Nb/sub 3/ (Al,Si), were readily obtained. Nb/sub 3/Sn conductors made by the infiltration process exhibit a critical temperature (Tc) of 18.1 K and a critical current carrying capacity (I/sub c/) …

First-principles total energy calculation based on the exact muffin-tin orbital and full potential linear muffin-tin orbital methods were used to calculate the equation of state and shear elastic constants of bcc V, Nb, and the V{sub 95}Nb{sub 05} disordered alloy as a function of pressure up to 6 Mbar. We found a mechanical instability in C{sub 44} and a corresponding softening in C at pressures {approx} 2 Mbar for V. Both shear elastic constants show softening at pressures {approx} 0.5 Mbar for Nb. Substitution of 5 at. % of V with Nb removes the instability of V with respect to trigonal distortions in the vicinity of 2 Mbar pressure, but still leaves the softening of C{sub 44} in this pressure region. We argue that the pressure induced shear instability (softening) of V (Nb) originates from the electronic system and can be explained by a combination of the Fermi surface nesting, electronic topological transition, and band Jahn-Teller effect.

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The structures and energies of the molten salt vapor complexes LiAlF{sub 4} and NaAlF{sub 4} are studied using new high level ab initio molecular orbital methods. The structures are determined using Moller-Plesset perturbation theory to second-order and the total energies are determined using a recently introduced modification of Gaussian-2 (G2) theory. The total energies are used to determine relative energies of the corner-, edge-, and face-bridged structures and accurate reaction energies. The results are compared to previous theoretical and experimental studies.

We propose an importance truncation scheme for the no-core shell model, which enables converged calculations for nuclei well beyond the p-shell. It is based on an a priori measure for the importance of individual basis states constructed by means of many-body perturbation theory. Only the physically relevant states of the no-core model space are considered, which leads to a dramatic reduction of the basis dimension. We analyze the validity and efficiency of this truncation scheme using different realistic nucleon-nucleon interactions and compare to conventional no-core shell model calculations for {sup 4}He and {sup 16}O. Then, we present the first converged calculations for the ground state of {sup 40}Ca within no-core model spaces including up to 16{h_bar}{Omega}-excitations using realistic low-momentum interactions. The scheme is universal and can be easily applied to other quantum many-body problems.