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At least 91 records · Page 5

A Broadband Laboratory Study of the Seismic Properties of Cracked and Fluid-Saturated Synthetic Glass Media

In this paper, for better understanding of frequency dependence (dispersion) of seismic wave velocities caused by stress-induced fluid flow, broadband laboratory measurements were performed on a suite of synthetic glass media containing both equant pores and thermal cracks. Complementary forced oscillation, resonant bar, and ultrasonic techniques provided access to millihertz-hertz frequencies, ~1 kHz frequency, and ~1 MHz frequency, respectively. The wave speeds or effective elastic moduli and associated dissipation were measured on samples under dry, argon- or nitrogen-saturated, and water-saturated conditions in sequence. The elastic moduli, in situ permeability, and crack porosity inferred from in situ X-ray computed tomography all attest to strong pressure-induced crack closure for differential (confining-minus-pore) pressures <30 MPa, consistent with zero-pressure crack aspect ratios <4 × 10 -4 . The low permeabilities of these materials allow access to undrained conditions, even at subhertz frequencies. The ultrasonically measured elastic moduli reveal consistently higher shear and bulk moduli upon fluid saturation—diagnostic of the saturated-isolated regime. For a glass rod specimen, containing cracks but no pores, saturated-isolated conditions apparently persist to subhertz frequencies—requiring in situ aspect ratios (minimum/maximum dimension) <10 -5 . In marked contrast, the shear modulus measured at subhertz frequencies on a cracked glass bead specimen of 5% porosity, is insensitive to fluid saturation, consistent with the Biot-Gassmann model for the saturated-isobaric regime. Finally, the measured dispersion of the shear modulus approaches 10% over the millihertz-megahertz frequency range for the cracked and fluid-saturated media—implying that laboratory ultrasonic data should be used with care in the interpretation of field data.

58 GEOSCIENCES↗

Fuel convergence sensitivity in indirect drive implosions

In inertial confinement fusion experiments at the National Ignition Facility, a spherical shell of deuterium–tritium fuel is imploded in an attempt to reach the conditions needed for fusion, self-heating, and eventual ignition. Since theory and simulations indicate that ignition efficacy in 1D improves with increasing imploded fuel convergence ratio, it is useful to understand the sensitivity of the scale-invariant fuel convergence on all measurable or inferable 1D parameters. In this paper, we develop a simple isobaric and isentropic compression scaling model incorporating sensitivity to the in-flight adiabat inferred from shock strengths, to measured implosion velocity, and to known initial ablator and fuel aspect ratio and mass ratio. The model is first benchmarked to 1D implosion simulations spanning a variety of relevant implosion designs. We then use the model to compare compressibility trends across all existing indirect-drive layered implosion data from the facility spanning three ablators [CH, carbon (C), and Be], for which in-flight fuel adiabats varied from 1.6 to 5 by varying the number of drive shocks from 2 to 4, peak implosion velocities varied by 1.4×, capsule radii by 50%, and initial fuel aspect ratios by 1.4×. We find that the strength of the first shock is the dominant contributor setting the maximum fuel convergence. We also observe additional sensitivities to successive shock strengths and fuel aspect ratios that improve the agreement between the expected and measured compression for carbon and Be designs with adiabats above 3. A principal finding is that the adiabat 2.5 C-shell designs exhibit less convergence than CH-shell designs of similar inferred in-flight adiabat.

Landen, O. L. (ORCID:0000000214998217)↗

The interpretation of temperature and salinity variables in numerical ocean model output and the calculation of heat fluxes and heat content

Abstract. The international Thermodynamic Equation of Seawater 2010 (TEOS-10) defined the enthalpy and entropy of seawater, thus enabling the global ocean heat content to be calculated as the volume integral of the product of in situ density, ρ, and potential enthalpy, h0 (with reference sea pressure of 0 dbar). In terms of Conservative Temperature, Θ, ocean heat content is the volume integral of ρcp0Θ, where cp0 is a constant “isobaric heat capacity”. However, many ocean models in the Coupled Model Intercomparison Project Phase 6 (CMIP6) as well as all models that contributed to earlier phases, such as CMIP5, CMIP3, CMIP2, and CMIP1, used EOS-80 (Equation of State – 1980) rather than the updated TEOS-10, so the question arises of how the salinity and temperature variables in these models should be physically interpreted, with a particular focus on comparison to TEOS-10-compliant observations. In this article we address how heat content, surface heat fluxes, and the meridional heat transport are best calculated using output from these models and how these quantities should be compared with those calculated from corresponding observations. We conclude that even though a model uses the EOS-80, which expects potential temperature as its input temperature, the most appropriate interpretation of the model's temperature variable is actually Conservative Temperature. This perhaps unexpected interpretation is needed to ensure that the air–sea heat flux that leaves and arrives in atmosphere and sea ice models is the same as that which arrives in and leaves the ocean model. We also show that the salinity variable carried by present TEOS-10-based models is Preformed Salinity, while the salinity variable of EOS-80-based models is also proportional to Preformed Salinity. These interpretations of the salinity and temperature variables in ocean models are an update on the comprehensive Griffies et al. (2016) paper that discusses the interpretation of many aspects of coupled Earth system models.

54 ENVIRONMENTAL SCIENCES↗

Exploring rapidity-even dipolar flow in isobaric collisions at RHIC

Abstract Employing the AMPT transport model, we investigate the response of the rapidity-even dipolar flow ( v 1 even ) and its associated Global Momentum Conservation (GMC) parameterKto structural disparities within 96 Ru and 96 Zr nuclei. We analyze Ru + Ru and Zr + Zr collisions at a center-of-mass energy of s NN = 200 GeV. Our analysis demonstrates that the eccentricityε 1 , v 1 even andKexhibit subtle yet discernible sensitivity to the input nuclear structure distinctions between 96 Ru and 96 Zr isobars. This observation suggests that measuring v 1 even and the GMC parameter in these isobaric collisions could serve as a means to fine-tune the comprehension of their nuclear structure disparities and offer insights to enhance the initial condition assumptions of theoretical models.

Physics↗

A first-order estimate of shock heating and vaporization in oceanic impacts

The vaporization of water in oceanic impacts of asteroids or comets of multikilometer dimensions is estimated by a semianalytical modeling of impact heating and shock isobar geometry that is based on computer code calculations. The mass of water vaporized in an infinitely deep ocean by the impact of a 10 km diameter asteroid at 25 km/sec (these values have been proposed for the Cretaceous/Tertiary extinction bolide) is approximately equal to the total mass of water vapor present in the earth's atmosphere, and 3-4 orders of magnitude larger than the mass of water vapor in the stratosphere. For projectiles of this size, however, the finite depth of the ocean becomes significant and may considerably reduce the amount of water vapor initially generated by the impact. Climatological models and extinction scenarios invoking the effects of impact-generated water vapor may critically depend on the a priori ambiguous details of the hypothesized impact.

Croft, S. K.↗

Nested sampling of isobaric phase space for the direct evaluation of the isothermal-isobaric partition function of atomic systems

Nested Sampling (NS) is a powerful athermal statistical mechanical sampling technique that directly calculates the partition function, and hence gives access to all thermodynamic quantities in absolute terms, including absolute free energies and absolute entropies. NS has been used predominately to compute the canonical (NVT) partition function. Although NS has recently been used to obtain the isothermal-isobaric (NPT) partition function of the hard sphere model, a general approach to the computation of the NPT partition function has yet to be developed. Here, we describe an isobaric NS (IBNS) method which allows for the computation of the NPT partition function of any atomic system. We demonstrate IBNS on two finite Lennard-Jones systems and confirm the results through comparison to parallel tempering Monte Carlo. Temperature-entropy plots are constructed as well as a simple pressure-temperature phase diagram for each system. We further demonstrate IBNS by computing part of the pressure-temperature phase diagram of a Lennard-Jones system under periodic boundary conditions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Tracing baryon and electric charge transport in isobar collisions

It is of fundamental interest to understand the carrier of conserved quantum charges within protons and nuclei at high energy. Preliminary data from isobar collisions at RHIC reveal a scaled net-baryon to net-electric charge ratio (B/ΔQ × ΔZ/A) at midrapidity between 1.2 and 2, consistent with string junction model predictions. Here, we compute the initial stage scaled net baryon to net-electric charge ratio for isobar collisions. Our model incorporates a realization of the string junction model and models the nuclear structure. Our predictions identify the baseline expectations for such measurement and quantify the impact of the nuclear structure.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Differentiation of a very thick magma body and implications for the source regions of mare basalts

Mass-balance calculations indicate that the molten layer originally covering the moon may have been several hundred kilometers deep. The solidification of this magma ocean involved some unusual effects resulting from the large-pressure differential in the thick magma layer. The sunken cumulates from this differentiation would be more iron-rich, less refractory, and would contain more incompatible elements than would be expected in simple isobaric fractional crystallization and crystal sinking models of magma differentiation. These lower cumulates can have the mineralogical and chemical properties of the source regions of the low-Ti mare basalts.

Walker, D.↗

Highly ionized gas in the Galactic halo

We reexamine the values of electron density n(sub e) and gas pressure P/k in the interstellar medium (ISM) of the Galactic halo, as inferred from C IV emission and absorption lines and using current C IV atomic data. In a homogeneous model with 4.7 less than or equal to log T less than or equal to 5.3, the data are consistent with 0.01 less than or equal to n(sub e) less than or equal to 0.02/cu cm and 2200 less than or equal to P/k less than or equal to 3700/cu cm K, a factor of 2-3 higher than advocated by Martin & Bowyer (1990) and comparable to the thermal pressure in the disk. If some of the C IV absorption arises from nonemitting, photoionized gas, then the inferred density and pressure will increase accordingly. The volume filling factor for homogeneous models ranges from 0.5% to 5%. Because of the constraints arising from filling factor and radiated power, most of the C IV must arise from gas near the peak of the cooling curve, at log t less than or equal to 5.6. We relate both emission-line and absorption-line observations to recent models in which turbulent mixing layers and isobarically cooling supernova remnants (SNRs) provide significant amounts of halo gas at approximately 10(exp 5.3) K and process 20-40 solar mass/yr with a power of approximately 10(exp 41) ergs/sec. Since the observed C IV and N V absorption scale heights have been reported to differ, at 4.9 kpc and 1.6 kpc, respectively, we examine inhomogeneous models with different exponential scale heights of T, P, and SN energy input. The ISM may change its character with distance above the Galactic plane, as superbubbles and mixing layers dominate over isolated SNRs as the source of the C IV. For appropiate scale heights, the midplane pressure is twice the homogeneous values quoted above. The O IV lambda 1034 diffuse emission line, which can be used as a temperature diagnostic of the hot gas, is predicted to be comparable in strength to that of C IV lambda 1549 (approximately 6000 photons/cu cm/s/sr. The ions C IV, N V, and O VI are predicted to show a decreasing trend in vertical extent, with the O IV scale height perhaps as low as approximately 1 kpc.

Shull, J. Michael↗

Unitary Bethe-Salpeter Methods in Two- and Three-Body Systems

The study of resonances, unstable particles formed in particle scattering, is motivated by the questions about the strong interaction and the composition of hadrons. In order to advance this study in the intermediate energy region, a variety of techniques are used. In this thesis, we present work done on two different analyses that use the principle of unitarity and the Bethe-Salpeter equation to study the resonances Lambda(1405), Sigma(1385), and a1(1260). Firstly, we perform a simultaneous analysis of Sand P-waves of the Strangeness = -1 two-body meson-baryon scattering amplitude using all low-energy data. For the first time, differential cross section data are included for chiral unitary coupled-channel models. From this model, S- and P-wave amplitudes are extracted and we observe both well-known I(JP)=0(1/2^-) S-wave states as well as a new I(JP)=1(1/2^+) state absent in quark models and lattice QCD results. Multiple statistical and phenomenological tests suggest that, while the data clearly require an I =1 P-wave resonance, the new state just accounts for the absence of the decuplet Sigma(1385)3/2+ in the model which is subsequently included in the parameterization. Secondly, we formulate the final state interaction of the a1(1260) resonance decay in a manifestly three-body-unitary parameterization and fit it to the a1(1260) lineshape measured by the ALEPH experiment. Dalitz plots calculated from this fit are presented. The work demonstrates the feasibility to numerically solve a previously derived amplitude and its generalization to isobars with spin and coupled channels. The model is a good test case because it can also be applied to other meson decays including exotic states and modified for the finite-volume problem as it arises in lattice QCD due to its manifest unitarity. The understanding of the resonances being analyzed in both the two-body work and the three-body work gives a better understanding of intermediate energy QCD.

Sadasivan, Daniel↗

Theoretical quasar emission-line ratios. VII - Energy-balance models for finite hydrogen slabs

The present energy balance calculations for finite, isobaric, hydrogen-slab quasar emission line clouds incorporate probabilistic radiative transfer (RT) in all lines and bound-free continua of a five-level continuum model hydrogen atom. Attention is given to the line ratios, line formation regions, level populations and model applicability results obtained. H lines and a variety of other considerations suggest the possibility of emission line cloud densities in excess of 10 to the 10th/cu cm. Lyman-beta/Lyman-alpha line ratios that are in agreement with observed values are obtained by the models. The observed Lyman/Balmer ratios can be achieved with clouds whose column depths are about 10 to the 22nd/sq cm.

Hubbard, E. N.↗

Evidence for a liquid-liquid critical point in supercooled water within the E3B3 model and a possible interpretation of the kink in the homogeneous nucleation line

Supercooled water exhibits many thermodynamic anomalies, and several scenarios have been proposed to interpret them, among which the liquid-liquid critical point (LLCP) hypothesis is the most commonly discussed. We investigated Widom lines and the LLCP of deeply supercooled water, by using molecular dynamics simulation with a newly reparameterized water model that explicitly includes three-body interactions. Seven isobars are studied from ambient pressure to 2.5 kbar, and Widom lines are identified by calculating maxima in the coefficient of thermal expansion and the isothermal compressibility (both with respect to temperature). From these data we estimate that the LLCP of the new water model is at 180 K and 2.1 kbar. The oxygen radial distribution function is calculated along the 2 kbar isobar. It shows a steep change in the height of its second peak between 180 and 185 K, which indicates a transition between the high-density liquid and low-density liquid phases and which is consistent with the ascribed location of the critical point. The good agreement of the height of the second peak of the radial distribution function between simulation and experiment at 1 bar, as a function of temperature, supports the validity of the model. The location of the LLCP within the model is close to the kink in the experimental homogeneous nucleation line. We use existing experimental data to argue that the experimental LLCP is at 168 K and 1.95 kbar and speculate how this LLCP and its Widom line might be responsible for the kink in the homogeneous nucleation line.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Radiochemical transport analysis of gamma spectroscopic data to support estimation of molten salt reactor off-gas inventories

This work introduces a novel application of radiochronometry to estimate nuclide inventories in molten salt reactor off-gas systems based on gamma spectroscopic data from the Molten Salt Reactor Experiment. By analyzing isotopic, isobaric, and isomeric activity ratios, key depletion model parameters related to species transport within the reactor system could be inferred. The findings demonstrate the potential of leveraging a limited subset of gamma spectroscopy measurements to accurately estimate nuclide inventories throughout the off-gas system. The approach can be useful in reactor design activities and support analyses relevant to operations, safety, security, and safeguards.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Bridging material models across scales: An integrated approach to equation of state and molecular dynamics modeling of copper

New uncertainty-aware equation of state (EOS) and electrical conductivity (EC) models for copper have been developed. The multiphase EOS/EC models are fit to experimental solid/liquid EC isobar measurements as well as density-functional theory molecular dynamics (DFT-MD) EC calculations in both expanded and compressed regimes (0.1–16 g/ cm 3 ⁠). The liquid and solid EOS phases were fit to available experimental data along with additional DFT-MD data over the same range as the EC. Leveraging the DFT-MD data, a corresponding machine-learned interatomic potential (MLIAP) for copper was trained using genetic-algorithm optimization. The copper MLIAP was constrained by EOS shock points at high compressions. The final EOS bounded MLIAP proves to be stable over a large density range (approximately 0.1–20 g/ cm 3 ) with good agreement to an isothermal compression curve, shock Hugoniot, and liquid speed of sound measurements at high pressures (100s of GPa).

Acoustic measurements and instrumentation↗

Dalitz plots and lineshape of a 1 ( 1260 ) from a relativistic three-body unitary approach

We formulate the final-state interaction of the a 1 ( 1260 ) resonance decay in a manifestly three-body unitary parametrization and fit it to the a 1 ( 1260 ) line shape measured by the ALEPH experiment. Dalitz plots calculated from this fit are presented. The work demonstrates the feasibility to numerically solve a previously derived amplitude and its generalization to isobars with spin and coupled channels. The model can also be applied to other meson decays and modified for the finite-volume problem as it arises in lattice QCD due to its manifest unitarity.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Temperature dependence of phonons in FeGe 2

Inelastic neutron scattering was used to measure phonon dispersions in a single crystal of FeGe 2 with the C16 structure at 300, 500, and 635 K. Phonon densities of states (DOS) were also measured on polycrystalline FeGe 2 from 325 to 1050 K, and the Fe partial DOS was obtained from polycrystalline 57 FeGe 2 at 300 K using nuclear resonant inelastic x-ray scattering. The dominant feature in the temperature dependence of the phonon spectrum is thermal broadening of high-energy modes. The energy shifts of the low- and high-energy parts of the spectrum were almost the same. DFT calculations performed with the quasiharmonic approximation gave results in moderate agreement with the experimental thermal energy shifts, although the isobaric Grüneisen parameter calculated from the quasiharmonic model was smaller than that from measurements. The thermal broadening of the phonon spectrum and dispersions, especially at high energies, indicates a cubic anharmonicity to second order that should also induce phonon shifts. Lastly, we show that different anharmonic contributions cancel out, giving average phonon shifts in moderate agreement to calculations with the quasiharmonic approximation. The different parts of the large phonon contribution to the entropy are separated for FeGe 2 , showing modest but interpretable anharmonic contributions.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Heating-induced glass-glass and glass-liquid transformations in computer simulations of water

Water exists in at least two families of glassy states, broadly categorized as the low-density (LDA) and high-density amorphous ice (HDA). Remarkably, LDA and HDA can be reversibly interconverted via appropriate thermodynamic paths, such as isothermal compression and isobaric heating, exhibiting first-order-like phase transitions. We perform out-of-equilibrium molecular dynamics simulations of glassy water using the ST2 model to study the evolution of LDA and HDA upon isobaric heating. Depending on pressure, glass-to-glass, glass-to-crystal, glass-to-vapor, as well as glass-to-liquid transformations are found. Specifically, heating LDA results in the following transformations, with increasing heating pressures: (i) LDA-to-vapor (sublimation), (ii) LDA-to-liquid (glass transition), (iii) LDA-to-HDA-to-liquid, (iv) LDA-to-HDA-to-liquid-to-crystal, and (v) LDA-to-HDA-to-crystal. Similarly, heating HDA results in the following transformations, with decreasing heating pressures: (a) HDA-to-crystal, (b) HDA-to-liquid-to-crystal, (c) HDA-to-liquid (glass transition), (d) HDA-to-LDA-to-liquid, and (e) HDA-to-LDA-to-vapor. A more complex sequence may be possible using lower heating rates. For each of these transformations, we determine the corresponding transformation temperature as function of pressure, and provide a P-T “phase diagram” for glassy water based on isobaric heating. Our results for isobaric heating dovetail with the LDA-HDA transformations reported for ST2 glassy water based on isothermal compression/decompression processes [Chiu et al., J. Chem. Phys. 139, 184504 (2013)]. The resulting phase diagram is consistent with the liquid-liquid phase transition hypothesis. At the same time, the glass phase diagram is sensitive to sample preparation, such as heating or compression rates. Interestingly, at least for the rates explored, our results suggest that the LDA-to-liquid (HDA-to-liquid) and LDA-to-HDA (HDA-to-LDA) transformation lines on heating are related, both being associated with the limit of kinetic stability of LDA (HDA)

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

A Multiphase Model for the Intracluster Medium

Constraints on the clustered mass density of the universe derived from the observed population mean intracluster gas fraction of x-ray clusters may be biased by reliance on a single-phase assumption for the thermodynamic structure of the intracluster medium (ICM). We propose a descriptive model for multiphase structure in which a spherically symmetric ICM contains isobaric density perturbations with a radially dependent variance. Fixing the x-ray emission and emission weighted temperature, we explore two independently observable signatures of the model in the parameter space. For bremsstrahlung dominated emission, the central Sunyaev-Zel'dovich (SZ) decrement in the multiphase case is increased over the single-phase case and multiphase x-ray spectra in the range 0.1-20 keV are flatter in the continuum and exhibit stronger low energy emission lines than their single-phase counterpart. We quantify these effects for a fiducial 10e8 K cluster and demonstrate how the combination of SZ and x-ray spectroscopy can be used to identify a preferred location in the plane of the model parameter space. From these parameters the correct value of mean intracluster gas fraction in the multiphase model results, allowing an unbiased estimate of clustered mass density to he recovered.

Nagai, Daisuke↗