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At least 163 records · Page 9

PRELUDE TO A DOUBLE DEGENERATE MERGER: THE ONSET OF MASS TRANSFER AND ITS IMPACT ON GRAVITATIONAL WAVES AND SURFACE DETONATIONS

We present the results of a systematic numerical study of the onset of mass transfer in double degenerate binary systems and its impact on the subsequent evolution. All investigated systems belong to the regime of direct impact, unstable mass transfer. In all of the investigated cases, even those considered unstable by conventional stability analysis, we find a long-lived mass transfer phase continuing for as many as several dozen orbital periods. This settles a recent debate sparked by a discrepancy between earlier smoothed particle hydrodynamics (SPH) calculations that showed disruptions after a few orbital periods and newer grid-based studies in which mass transfer continued for tens of orbits. The number of orbits a binary survives sensitively depends on the exact initial conditions. We find that the approximate initial conditions that have been used in most previous SPH calculations have a serious impact on all stages of the evolution from the onset of mass transfer up to the final structure of the remnant. We compare 'approximate' initial conditions where spherical stars are placed at an initial separation obtained from an estimate of the Roche lobe size with 'accurate' initial conditions that were constructed by carefully driving the binary system to equilibrium by a relaxation scheme. Simulations that use the approximate initial conditions underestimate the initial separation when mass transfer sets in, which yields a binary that only survives for only a few orbits and thus a rapidly fading gravitational wave signal. Conversely, the accurate initial conditions produce a binary system in which the mass transfer phase is extended by almost two orders of magnitude in time, resulting in a gravitational wave signal with amplitude and frequency that remain essentially constant up until merger. As we show that these binaries can survive at small separation for hundreds of orbital periods, their associated gravitational wave signal should be included when calculating the gravitational wave foreground (although expected to be below Laser Interferometer Space Antenna's sensitivity at these high frequencies). We also show that the inclusion of the entropy increase associated with shock heating of the accreted material reduces the number of orbits a binary survives given the same initial conditions, although the effect is not as pronounced when using the appropriate initial conditions. The use of accurate initial conditions and a correct treatment of shock heating allows for a reliable time evolution of the temperature, density, and angular momentum, which are important when considering thermonuclear events that may occur during the mass transfer phase and/or after merger. Our treatment allows us to accurately identify when surface detonations may occur in the lead-up to the merger, as well as the properties of final merger products.

79 ASTRONOMY AND ASTROPHYSICS↗

COSMOLOGICAL EVOLUTION OF SUPERMASSIVE BLACK HOLES. I. MASS FUNCTION AT 0 < z {approx}< 2

We present the mass function of supermassive black holes (SMBHs) over the redshift range z = 0-2, using the latest deep luminosity and mass functions of field galaxies to constrain the masses of their spheroids, which we relate to SMBH mass through the empirical correlation between SMBH and spheroid mass (the M{sub .}-M{sub sph} relation). In addition to luminosity fading of the stellar content of the spheroids, we carefully consider the variation of the bulge-to-total luminosity ratio of the galaxy populations and the M{sub .}/M{sub sph} ratio, which, according to numerous recent studies, evolves rapidly with redshift. The SMBH mass functions derived from the galaxy luminosity and mass functions show very good agreement, both in shape and in normalization. The resultant SMBH mass function and integrated mass density for the local epoch (z Almost-Equal-To 0) match well those derived independently by other studies. Consistent with other evidence for cosmic downsizing, the upper end of the mass function remains roughly constant since z Almost-Equal-To 2, while the space density of lower mass black holes undergoes strong evolution. We carefully assess the impact of various sources of uncertainties on our calculations. A companion paper uses the mass function derived in this work to determine the radiative efficiency of black hole accretion and constraints that can be imposed on the cosmological evolution of black hole spin.

79 ASTRONOMY AND ASTROPHYSICS↗

THE RELATION BETWEEN BLACK HOLE MASS AND HOST SPHEROID STELLAR MASS OUT TO z {approx} 2

We combine Hubble Space Telescope images from the Great Observatories Origins Deep Survey with archival Very Large Telescope and Keck spectra of a sample of 11 X-ray-selected broad-line active galactic nuclei in the redshift range 1 < z < 2 to study the black-hole-mass-stellar-mass relation out to a look-back time of 10 Gyr. Stellar masses of the spheroidal component (M{sub sph,*}) are derived from multi-filter surface photometry. Black hole masses (M{sub BH}) are estimated from the width of the broad Mg II emission line and the 3000 A nuclear luminosity. Comparing with a uniformly measured local sample and taking into account selection effects, we find evolution in the form M{sub BH}/M{sub sph,*}{proportional_to}(1 + z){sup 1.96{+-}}0{sup .55}, in agreement with our earlier studies based on spheroid luminosity. However, this result is more accurate because it does not require a correction for luminosity evolution and therefore avoids the related and dominant systematic uncertainty. We also measure total stellar masses (M{sub host,*}). Combining our sample with data from the literature, we find M{sub BH}/M{sub host,*}{proportional_to}(1 + z){sup 1.15{+-}0.15}, consistent with the hypothesis that black holes (in the range M{sub BH} {approx} 10{sup 8-9} M{sub Sun }) pre-date the formation of their host galaxies. Roughly, one-third of our objects reside in spiral galaxies; none of the host galaxies reveal signs of interaction or major merger activity. Combined with the slower evolution in host stellar masses compared to spheroid stellar masses, our results indicate that secular evolution or minor mergers play a non-negligible role in growing both BHs and spheroids.

79 ASTRONOMY AND ASTROPHYSICS↗

NON-RELATIVISTIC RADIATION MEDIATED SHOCK BREAKOUTS. II. BOLOMETRIC PROPERTIES OF SUPERNOVA SHOCK BREAKOUT

Exact bolometric light curves of supernova shock breakouts are derived based on the universal, non-relativistic, planar breakout solutions, assuming spherical symmetry, constant Thomson scattering opacity, {kappa}, and angular intensity corresponding to the steady-state planar limit. These approximations are accurate for progenitors with a scale height much smaller than the radius. The light curves are insensitive to the density profile and are determined by the progenitor radius R, and the breakout velocity and density, v{sub 0} and {rho}{sub 0}, respectively, and {kappa}. The total breakout energy, E{sub BO}, and the maximal ejecta velocity, v{sub max}, are shown to be E{sub BO} = 8.0{pi}R{sup 2}{kappa}{sup -1} cv{sub 0} and v{sub max} = 2.0v{sub 0}, respectively, to an accuracy of about 10%. The calculated light curves are valid up to the time of transition to spherical expansion, t{sub sph} Almost-Equal-To R/4v{sub 0}. Approximate analytic expressions for the light curves are provided for breakouts in which the shock crossing time at breakout, t{sub 0} = c/{kappa}{rho}{sub 0} v{sup 2}{sub 0}, is <<R/c (valid for R < 10{sup 14} cm). Modifications of the flux angular intensity distribution and differences in shock arrival times to the surface, {Delta}t{sub asym}, due to moderately asymmetric explosions, affect the early light curve but do not affect v{sub max} and E{sub BO}. For 4v{sub 0} << c, valid for large (red supergiant) progenitors, L{proportional_to}t{sup -4/3} at max ({Delta}t{sub asym}, R/c) < t < t{sub sph} and R may be accurately estimated from R Almost-Equal-To 2 Multiplication-Sign 10{sup 13}(L/10{sup 43} erg s{sup -1}){sup 2/5}(t/1 hr){sup 8/15}.

79 ASTRONOMY AND ASTROPHYSICS↗

THERMAL AND DYNAMICAL PROPERTIES OF GAS ACCRETING ONTO A SUPERMASSIVE BLACK HOLE IN AN ACTIVE GALACTIC NUCLEUS

We study stability of gas accretion in active galactic nuclei (AGNs). Our grid-based simulations cover a radial range from 0.1 to 200 pc, which may enable linking the galactic/cosmological simulations with small-scale black hole (BH) accretion models within a few hundreds of Schwarzschild radii. Here, as in previous studies by our group, we include gas radiative cooling as well as heating by a sub-Eddington X-ray source near the central supermassive BH of 10{sup 8} M{sub Sun }. Our theoretical estimates and simulations show that for the X-ray luminosity, L{sub X} {approx} 0.008 L{sub Edd}, the gas is thermally and convectively unstable within the computational domain. In the simulations, we observe that very tiny fluctuations in an initially smooth, spherically symmetric, accretion flow, grow first linearly and then nonlinearly. Consequently, an initially one-phase flow relatively quickly transitions into a two-phase/cold-hot accretion flow. For L{sub X} = 0.015 L{sub Edd} or higher, the cold clouds continue to accrete but in some regions of the hot phase, the gas starts to move outward. For L{sub X} < 0.015 L{sub Edd}, the cold phase contribution to the total mass accretion rate only moderately dominates over the hot phase contribution. This result might have some consequences for cosmological simulations of the so-called AGN feedback problem. Our simulations confirm the previous results of Barai et al. who used smoothed particle hydrodynamic (SPH) simulations to tackle the same problem. Here, however, because we use a grid-based code to solve equations in one dimension and two dimensions, we are able to follow the gas dynamics at much higher spacial resolution and for longer time compared with the three-dimensional SPH simulations. One of the new features revealed by our simulations is that the cold condensations in the accretion flow initially form long filaments, but at the later times, those filaments may break into smaller clouds advected outward within the hot outflow. Therefore, these simulations may serve as an attractive model for the so-called narrow-line region in AGNs.

79 ASTRONOMY AND ASTROPHYSICS↗

The NUV–r versus M{sub r} plane as a tracer of early-type galaxy evolution in the USGC U376 and LGG 225 groups

With the aim of tracing back the evolution of galaxies in nearby groups, we use smooth particle hydrodynamical (SPH) simulations with chemo-photometric implementation. Here, we focus on the evolution of the early-type members (Es and S0s; ETGs hereafter) in two groups, USGC U376 and LGG 225, both in the Leo cloud. We use the near-UV (NUV)-optical rest-frame NUV–r versus M{sub r} color-magnitude diagram to follow their evolution, from the blue cloud (BC) to the red sequence (RS), through the green valley (GV). ETGs brighter than M{sub r} = –21 mag are older than 13 Gyr and spend up to 10 Gyr of their overall evolutionary time in the BC before they reach the RS, migrating through the GV. Fainter ETGs are younger, ≈2 Gyr on average, and evolve for about 7-8 Gyr along the BC. The turn-off occurs at z ≈ 0.3-0.4. Therefore, these ETGs spend up to 3-5 Gyr crossing the GV; UGC 06324, the faintest ETG in the sample, still is in the GV. The mechanism driving their evolution is gravitational, due to merging and/or interaction. Our SPH simulations suggest that ETG members of these groups evolved toward the RS before and during the group collapse phase. This result is consistent with the dynamical analysis of both groups showing that they are not yet virialized.

79 ASTRONOMY AND ASTROPHYSICS↗

FIRST INVESTIGATION OF THE COMBINED IMPACT OF IONIZING RADIATION AND MOMENTUM WINDS FROM A MASSIVE STAR ON A SELF-GRAVITATING CORE

Massive stars shape the surrounding interstellar matter (ISM) by emitting ionizing photons and ejecting material through stellar winds. To study the impact of the momentum from the wind of a massive star on the surrounding neutral or ionized material, we implemented a new HEALPix-based momentum-conserving wind scheme in the smoothed particle hydrodynamics (SPH) code SEREN. A qualitative study of the impact of the feedback from an O7.5-like star on a self-gravitating sphere shows that on its own, the transfer of momentum from a wind onto cold surrounding gas has both a compressing and dispersing effect. It mostly affects gas at low and intermediate densities. When combined with a stellar source's ionizing ultraviolet (UV) radiation, we find the momentum-driven wind to have little direct effect on the gas. We conclude that during a massive star's main sequence, the UV ionizing radiation is the main feedback mechanism shaping and compressing the cold gas. Overall, the wind's effects on the dense gas dynamics and on the triggering of star formation are very modest. The structures formed in the ionization-only simulation and in the combined feedback simulation are remarkably similar. However, in the combined feedback case, different SPH particles end up being compressed. This indicates that the microphysics of gas mixing differ between the two feedback simulations and that the winds can contribute to the localized redistribution and reshuffling of gas.

79 ASTRONOMY AND ASTROPHYSICS↗

A systematic study of carbon–oxygen white dwarf mergers: Mass combinations for type Ia supernovae

Mergers of two carbon–oxygen (CO) white dwarfs (WDs) have been considered to be progenitors of Type Ia supernovae (SNe Ia). Based on smoothed particle hydrodynamics (SPH) simulations, previous studies have claimed that mergers of CO WDs lead to SN Ia explosions either in the dynamical merger phase or the stationary rotating merger remnant phase. However, the mass range of CO WDs that lead to SNe Ia has not yet been clearly identified. In the present work, we perform systematic SPH merger simulations for the WD masses ranging from 0.5 M{sub ⊙} to 1.1 M{sub ⊙} with higher resolutions than the previous systematic surveys and examine whether or not carbon burning occurs dynamically or quiescently in each phase. We further study the possibility of SNe Ia explosions and estimate the mass range of CO WDs that lead to SNe Ia. We found that when both WDs are massive, i.e., in the mass range of 0.9 M{sub ⊙}⩽M{sub 1,2}⩽1.1 M{sub ⊙}, they can explode as an SN Ia in the merger phase. On the other hand, when the more massive WD is in the range of 0.7 M{sub ⊙}⩽M{sub 1}⩽0.9 M{sub ⊙} and the total mass exceeds 1.38 M{sub ⊙}, they can finally explode in the stationary rotating merger remnant phase. We estimate the contribution of CO WD mergers to the entire SN Ia rate in our galaxy to be of ≲9%. Thus, it might be difficult to explain all galactic SNe Ia with CO WD mergers.

79 ASTRONOMY AND ASTROPHYSICS↗

DIRECT FORMATION OF SUPERMASSIVE BLACK HOLES IN METAL-ENRICHED GAS AT THE HEART OF HIGH-REDSHIFT GALAXY MERGERS

We present novel 3D multi-scale smoothed particle hydrodynamics (SPH) simulations of gas-rich galaxy mergers between the most massive galaxies at z ∼ 8–10, designed to scrutinize the direct collapse formation scenario for massive black hole seeds proposed in Mayer et al. The simulations achieve a resolution of 0.1 pc, and include both metallicity-dependent optically thin cooling and a model for thermal balance at high optical depth. We consider different formulations of the SPH hydrodynamical equations, including thermal and metal diffusion. When the two merging galaxy cores collide, gas infall produces a compact, optically thick nuclear disk with densities exceeding 10{sup −10} g cm{sup 3}. The disk rapidly accretes higher angular momentum gas from its surroundings reaching ∼5 pc and a mass of ≳10{sup 9} M{sub ⊙} in only a few 10{sup 4} years. Outside ≳2 pc it fragments into massive clumps. Instead, supersonic turbulence prevents fragmentation in the inner parsec region, which remains warm (∼3000–6000 K) and develops strong non-axisymmetric modes that cause prominent radial gas inflows (>10{sup 4} M{sub ⊙} yr{sup −1}), forming an ultra-dense massive disky core. Angular momentum transport by non-axisymmetric modes should continue below our spatial resolution limit, quickly turning the disky core into a supermassive protostar which can collapse directly into a massive black hole of mass 10{sup 8}–10{sup 9} M{sub ⊙} via the relativistic radial instability. Such a “cold direct collapse” explains naturally the early emergence of high-z QSOs. Its telltale signature would be a burst of gravitational waves in the frequency range of 10{sup −4}–10{sup −1} Hz, possibly detectable by the planned eLISA interferometer.

79 ASTRONOMY AND ASTROPHYSICS↗

TERAPIXEL IMAGING OF COSMOLOGICAL SIMULATIONS

The increasing size of cosmological simulations has led to the need for new visualization techniques. We focus on smoothed particle hydrodynamic (SPH) simulations run with the GADGET code and describe methods for visually accessing the entire simulation at full resolution. The simulation snapshots are rastered and processed on supercomputers into images that are ready to be accessed through a Web interface (GigaPan). This allows any scientist with a Web browser to interactively explore simulation data sets in both spatial and temporal dimensions and data sets which in their native format can be hundreds of terabytes in size or more. We present two examples, the first a static terapixel image of the MassiveBlack simulation, a P-GADGET SPH simulation with 65 billion particles, and the second an interactively zoomable animation of a different simulation with more than 1000 frames, each a gigapixel in size. Both are available for public access through the GigaPan Web interface. We also make our imaging software publicly available.

79 ASTRONOMY AND ASTROPHYSICS↗

A WELL-POSED KELVIN-HELMHOLTZ INSTABILITY TEST AND COMPARISON

Recently, there has been a significant level of discussion of the correct treatment of Kelvin-Helmholtz instability (KHI) in the astrophysical community. This discussion relies largely on how the KHI test is posed and analyzed. We pose a stringent test of the initial growth of the instability. The goal is to provide a rigorous methodology for verifying a code on two-dimensional KHI. We ran the problem in the Pencil Code, Athena, Enzo, NDSPMHD, and Phurbas. A strict comparison, judgment, or ranking, between codes is beyond the scope of this work, though this work provides the mathematical framework needed for such a study. Nonetheless, how the test is posed circumvents the issues raised by tests starting from a sharp contact discontinuity yet it still shows the poor performance of smoothed particle hydrodynamics (SPH). We then comment on the connection between this behavior to the underlying lack of zeroth-order consistency in SPH interpolation. We comment on the tendency of some methods, particularly those with very low numerical diffusion, to produce secondary Kelvin-Helmholtz billows on similar tests. Though the lack of a fixed, physical diffusive scale in the Euler equations lies at the root of the issue, we suggest that in some methods an extra diffusion operator should be used to damp the growth of instabilities arising from grid noise. This statement applies particularly to moving-mesh tessellation codes, but also to fixed-grid Godunov schemes.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Towards physics responsible for large-scale Lyman-α forest bias parameters

Using a series of carefully constructed numerical experiments based on hydrodynamic cosmological SPH simulations, we attempt to build an intuition for the relevant physics behind the large scale density (b δ ) and velocity gradient (b η ) biases of the Lyman-α forest. Starting with the fluctuating Gunn-Peterson approximation applied to the smoothed total density field in real-space, and progressing through redshift-space with no thermal broadening, redshift-space with thermal broadening and hydrodynamically simulated baryon fields, we investigate how approximations found in the literature fare. We find that Seljak's 2012 analytical formulae for these bias parameters work surprisingly well in the limit of no thermal broadening and linear redshift-space distortions. We also show that his b η formula is exact in the limit of no thermal broadening. Since introduction of thermal broadening significantly affects its value, we speculate that a combination of large-scale measurements of b η and the small scale flux PDF might be a sensitive probe of the thermal state of the IGM. Lastly, we find that large-scale biases derived from the smoothed total matter field are within 10–20% to those based on hydrodynamical quantities, in line with other measurements in the literature.

79 ASTRONOMY AND ASTROPHYSICS↗

Cusps in the center of galaxies: a real conflict with observations or a numerical artefact of cosmological simulations?

Galaxy observations and N-body cosmological simulations produce conflicting dark matter halo density profiles for galaxy central regions. While simulations suggest a cuspy and universal density profile (UDP) of this region, the majority of observations favor variable profiles with a core in the center. In this paper, we investigate the convergency of standard N-body simulations, especially in the cusp region, following the approach proposed by [1]. We simulate the well known Hernquist model using the SPH code Gadget-3 and consider the full array of dynamical parameters of the particles. We find that, although the cuspy profile is stable, all integrals of motion characterizing individual particles suffer strong unphysical variations along the whole halo, revealing an effective interaction between the test bodies. This result casts doubts on the reliability of the velocity distribution function obtained in the simulations. Moreover, we find unphysical Fokker-Planck streams of particles in the cusp region. The same streams should appear in cosmological N-body simulations, being strong enough to change the shape of the cusp or even to create it. Our analysis, based on the Hernquist model and the standard SPH code, strongly suggests that the UDPs generally found by the cosmological N-body simulations may be a consequence of numerical effects. A much better understanding of the N-body simulation convergency is necessary before a 'core-cusp problem' can properly be used to question the validity of the CDM model.

79 ASTRONOMY AND ASTROPHYSICS↗

Smoothed Particle Hydrodynamic Simulator

This code is a highly modular framework for developing smoothed particle hydrodynamic (SPH) simulations running on parallel platforms. The compartmentalization of the code allows for rapid development of new SPH applications and modifications of existing algorithms. The compartmentalization also allows changes in one part of the code used by many applications to instantly be made available to all applications.

Source record↗

Modeling the Structural Response from a Propagating High Explosive Using Smooth Particle Hydrodynamics

This report primarily concerns the use of two massively parallel finite element codes originally written and maintained at Lawrence Livermore National Laboratory. ALE3D is an explicit hydrodynamics code commonly employed to simulate wave propagation from high energy scenarios and the resulting interaction with nearby structures. This coupled response ensures that a structure is accurately applied with a blast loading varying both in space and time. Figure 1 illustrates the radial outward propagation of a pressure wave due to a center detonated spherical explosive originating from the lower left. The radial symmetry seen in this scenario is lost when instead a cylindrocal charge is detonated. Figure 2 indicates that a stronger, faster traveling pressure wave occurs in the direction of the normal axis to the cylinder. The ALE3D name is derived because of the use of arbitrary-Lagrange-Eulerian elements in which the mesh is allowed to advect; a process through which the mesh is modified to alleviate tanlging and general mesh distortion often cuased by high energy scenarios. The counterpart to an advecting element is a Lagrange element, whose mesh moves with the material. Ideally all structural components are kept Lagrange as long as possible to preserve accuracy of material variables and minimize advection related errors. Advection leads to mixed zoning, so using structural Lagrange elements also improves the visualization when post processing the results. A simplified representation of the advection process is shown in Figure 3. First the mesh is distorted due to material motion during the Lagrange step. The mesh is then shifted to an idealized and less distorted state to prevent irregular zones caused by the Lagrange motion. Lastly, the state variables are remapped to the elements of the newly constructed mesh. Note that Figure 3 represents a purely Eulerian mesh relaxation because the mesh is relocated back to the pre-Lagrange position. This is the case when the material flows through a still mesh. This is not typically done in an ALE3D analysis, especially if Lagrange elements exist. Deforming Lagrange elements would certainly tangle with a Eulerian mesh eventually. The best method in this case is to have an advecting mesh positioned as some relaxed version of the pre and post Lagrange step; this gives the best opportunity of modeling a high energy event with a combination of Lagrange and ALE elements. Dyne3D is another explicit dynamic analysis code, ParaDyn being the parallel version. ParaDyn is used for predicting the transient response of three dimensional structures using Lagrangian solid mechanics. Large deformation and mesh tangling is often resolved through the use of an element deletion scheme. This is useful to accommodate component failure, but if it is done purely as a means to preserve a useful mesh it can lead to problems because it does not maintain continuity of the material bulk response. Whatever medium exists between structural components is typically not modeled in ParaDyn. Instead, a structure either has a known loading profile applied or given initial conditions. The many included contact algorithms can calculate the loading response of materials if and when they collide. A recent implementation of an SPH module in which failed or deleted material nodes are converted to independent particles is currently being utilized for a variety of spall related problems and high velocity impact scenarios. Figure 4 shows an example of a projectile, given an initial velocity, and how it fails the first plate which generates SPH particles which then interact with and damage the second plate.

36 MATERIALS SCIENCE↗

Benchmark Analysis of the HTR-10 with the MAMMOTH Reactor Physics Application

This report documents a set of benchmarks used to validate the Serpent and MAMMOTH neutron transport models of the HTR-10 reactor developed at Idaho National Laboratory. The high-fidelity Serpent Monte Carlo models of the HTR-10 critical and full core configurations include both random, discrete distributions of TRISO particles in the pebbles and random, discrete pebble distributions in the pebble bed core. The Serpent results agree very well with the critical and control rod worth measurements provided in the International Re- actor Physics Experiment Evaluation Project (IRPhEP) report if the ENDF/B-VII.r1 data- set is used. These Serpent models are subsequently used to prepare cross sections and flux tallies in a 10 coarse energy group structure for the MAMMOTH Reactor Physics MOOSE- based application. We find that MAMMOTH can reproduce the Monte Carlo solution for the HTR-10 reactor by using the PJFNK-SPH equivalence method. In all cases studied, the MAMMOTH results are within 120 pcm of the Monte Carlo reference calculation and the maximum errors in neutron absorption and generation rates are within 0.536% and 0.215% from the reference calculation, respectively. A set of benchmark exercises from the International Atomic Energy Agency (IAEA) HTR-10 benchmark in IAEA-TECDOC-1382 were conducted including parts B1 (critical), B2 (temperature coefficient) and B3 (control rod worth). The results we obtain for the critical core are in excellent agreement with the expected value and we confirm that with ENDF/B-VII.r1 data we match the critical eigen- value keff=1 to within 100 pcm. Our temperature coefficient calculation is consistent with the VSOP results generated by the German participants. The Chinese and South African VSOP models produce lower temperature coefficients, a fact that was noted in the original IAEA benchmark, but for which no explanation was provided. Both a full and single control rod worth calculations with Serpent and MAMMOTH agree well with the results from the IAEA benchmark. Finally, and most importantly, this work demonstrates that MAM- MOTH can recover the Monte Carlo high-fidelity solutions to an excellent accuracy using the PJFNK-SPH method. This sets the stage for the ultimate goal of using MAMMOTH in transient, multi-physics scenarios where correction of the cross sections is obtained for steady-state conditions and then used in the transient scenario for which no Monte-Carlo solution is available.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Sierra/RKPM: Current State and Applications

The Reproducing Kernel Particle Method (RKPM), a meshfree method, has been implemented in Sandia's Sierra/Solid Mechanics in a collaboration between Sandia and the University of California San Diego's Center for Extreme Events Research (UCSD/CEER). Meshfree methods, like RKPM, have an advantage over mesh-based methods, like the Finite Element Method (FEM), in applications where achieving or maintaining a quality mesh becomes burdensome or impractical. For example, using FEM for problems with very large deformations will result in poor element Jacobians which causes problems with the parametric mapping. RKPM constructs the approximation functions in the physical domain, circumventing the parametric mapping issue. Also, reconstructing the approximation functions at very large deformations is straight-forward. RKPM has an advantage over traditional meshfree methods such as Smoothed-Particle Hydrodynamics (SPH) due to its ability to reproduce linear or higher-order functions exactly. This removes the tensile instabilities that are present in SPH and allows preservation of angular momentum. The point of this memo is to explore the capabilities and limitations of the current implementation by testing it on three different applications: 1) a quasi-static ductile shearing problem 2) a dynamic concrete panel perforation problem and 3) a set of dynamic metal panel perforation problems. In summary, areas where RKPM appears to be a promising alternative to current methods have been identified. Also, outstanding inefficiencies and issues (bugs) with code are noted, ways to improve the capabilities using material from literature are mentioned and areas deserving of new research are highlighted.

42 ENGINEERING↗

Optimization of Geometric Perturbations on a Rod Moving Through a High Explosive Target

After completing a study to ensure the simulation results were converged, several high resolution 3D Smoothed Particle Hydrodynamic (SPH) simulations of copper rods impacting a high explosive (LX14) target were performed. This was then formulated into an optimization problem: I wanted to find the optimum shape and location of a perturbation on the rod that would maximize its erosion after it left the target. The shape of the perturbation was modeled as a 2D Gaussian bump and parameterized by its location along the rod axis (z 0 ) and amplitude (A). The final mass of the coherent part of the rod as it leaves the target was used as a metric to represent the erosion of the rod, and the optimization was formulated to maximize this metric with respect to the aforementioned design variables. Due to the expensive nature of the high-fidelity 3D SPH simulations, a surrogate model needed to be chosen so that many function calls to the optimizer would be feasible. Thus, a strategic full factorial sampling plan was chosen to build a dataset, which consisted of 24 high-fidelity simulations. Two surrogate models, a third order polynomial regression model and a Gaussian Process Model, were analyzed using a 14%/86% test/train holdout technique. The root mean square and R2 score of the test set was used to determine the best model, and the third order polynomial regression model was chosen as the surrogate model. Finally, the Nelder-Mead Simplex and Basin-hopping optimization algorithms were implemented, and it was found that the two algorithms gave slightly different optimum values. Nelder-Mead gave an optimum point of [z* 0 ;A*] = [9:9;0:4] and Basin-Hopping gave an optimum value of x* = [z* 0 ;A*] = [9:2;0:1].

45 MILITARY TECHNOLOGY, WEAPONRY, AND NATIONAL DEF↗