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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 19 records

Exploring Mbar shock conditions and isochorically heated aluminum at the MEC end station of the LCLS

Recent experiments performed at the Matter in Extreme Conditions end station (MEC) of the Linac Coherent Light Source (LCLS) have demonstrated the first spectrally resolved measurements of plasmons from isochorically heated aluminum. The experiments have been performed using a seeded 8-keV x-ray laser beam as a pump and probe to both volumetrically heat and scatter x-rays from aluminum. Collective x-ray Thomson scattering spectra show a well-resolved plasmon feature that is down-shifted in energy by 19 eV. In addition, Mbar shock pressures from laser-compressed aluminum foils using Velocity Interferometer System for Any Reflector (VISAR) have been measured. The combination of experiments fully demonstrates the possibility to perform warm dense matter studies at the LCLS with unprecedented accuracy and precision.

INST, MATSCI, PHYS, XFEL↗

Fast temperature spectrometer for samples under extreme conditions

We have developed a multi-wavelength Fast Temperature Readout (FasTeR) spectrometer to capture a sample’s transient temperature fluctuations, and reduce uncertainties in melting temperature determination. Without sacrificing accuracy, FasTeR features a fast readout rate (about 100 Hz), high sensitivity, large dynamic range, and a well-constrained focus. Complimenting a charge-coupled device spectrometer, FasTeR consists of an array of photomultiplier tubes and optical dichroic filters. The temperatures determined by FasTeR outside of the vicinity of melting are, generally, in good agreement with results from the charge-coupled device spectrometer. Near melting, FasTeR is capable of capturing transient temperature fluctuations, at least on the order of 300 K/s. A software tool, SIMFaster, is described and has been developed to simulate FasTeR and assess design configurations. FasTeR is especially suitable for temperature determinations that utilize ultra-fast techniques under extreme conditions. Working in parallel with the laser-heated diamond-anvil cell, synchrotron Mössbauer spectroscopy, and X-ray diffraction, we have applied the FasTeR spectrometer to measure the melting temperature of {sup 57}Fe{sub 0.9}Ni{sub 0.1} at high pressure.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Fluorine chemistry at extreme conditions: possible synthesis of $HgF_4$

By irradiating a pressurized mixture of a fluorine-bearing compound ($XeF_2$) and $HgF_2$ with synchrotron hard x-rays (>7 keV) inside a diamond anvil cell, we have observed dramatic changes in the far-infrared spectrum within the 30-35 GPa pressure range which suggest that we may have formed $HgF_4$ in the following way: $XeF_2 \xrightarrow{hv} Xe + F_2$ (photochemically) and $HgF_2 + F_2 \rightarrow HgF_4$ (30 GPa < P < 35 GPa). This lends credence to recent theoretical calculations by Botana et al. that suggest that Hg may behave as a transition metal at high pressure in an environment with an excess of molecular fluorine. The spectral changes were observed to be reversible during pressure cycling above and below the above mentioned pressure range until a certain point when we suspect that molecular fluorine diffused out of the sample at lower pressure. Upon pressure release, $HgF_2$ and trace $XeF_2$ were observed to be remaining in the sample chamber suggesting that much of the $Xe$ and $F_2$ diffused and leaked out from the sample chamber. Received: 29 October 2018, Accepted: 18 January 2019; Edited by: A. Goñi, A. Cantarero, J. S. Reparaz; DOI: http://dx.doi.org/10.4279/PIP.110001 Cite as: M Pravica, S Schyck, B Harris, P Cifligu, E Kim, B Billinghurst, Papers in Physics 11, 110001 (2019). This paper, by M Pravica, S Schyck, B Harris, P Cifligu, E Kim, B Billinghurst, is licensed under the Creative Commons Attribution License 4.0.

Pravica, Michael G.↗

Synthesis of a novel strontium-based wide-bandgap semiconductor via X-ray photochemistry under extreme conditions

In this work, the synthesis and characterization of a novel, low cost, amorphous wide-bandgap semiconductor via X-ray induced decomposition of strontium oxalate at high pressure have been demonstrated. By means of IR spectroscopy, the final product is identified as a mixture of strontium carbonate, strontium oxalate and CO-derived materials. Band gap measurements demonstrate that the final product exhibits a much lower band gap (2.45 eV) than the initial strontium oxalate powder (4.07 eV), suggesting that the synthesized material can be highly useful in electronic and optical applications.

36 MATERIALS SCIENCE↗

Study of extreme nuclear shapes in extreme conditions

Studies of extreme nuclear shapes have always fascinated scientists and are being pursued quite strongly over the years. Nuclei present themselves with interesting shapes and structures at different conditions of spin, excitation and also with the number of neutrons and/or protons in them. Gamma decays from the Giant dipole Resonances in nuclei can probe directly their shapes at different extreme conditions by looking at their resonant line-shapes, e.g., Jacobi shapes and shape-transitions, super/hyper-deformation etc. Similar such studies, done for the first time, using the LAMBDA high energy gamma spectrometer developed at VECC, is discussed here.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Focusing adaptive-optics for neutron spectroscopy at extreme conditions

Neutron Spectroscopy employing extreme-conditions sample environments is nowadays a crucial tool for the understanding of fundamental scientific questions as well as for the investigation of materials and chemical-physical properties. For all these kinds of studies, an increased neutron flux over a small sample area is needed. The prototype of a focusing neutron guide component, developed and produced completely at the neutron source FRM II in Garching (Germany), has been installed at the time-of-flight (TOF) disc-chopper neutron spectrometer TOFTOF and came into routine-operation. The design is based on the compressed Archimedes' mirror concept for finite-size divergent sources. It represents a unique device combining the supermirror technology with Adaptive Optics, suitable for broad-bandwidth thermal-cold TOF neutron spectroscopy (here optimized for 1.4–10 Å). It is able to squeeze the beam cross section down to a square centimeter, with a more than doubled signal-to-background ratio, increased efficiency at high scattering angles, and improved symmetry of the elastic resolution function. We present a comparison between the simulated and measured beam cross sections, as well as the performance of the instrument within real experiments. This work intends to show the unprecedented opportunities achievable at already existing instruments, along with useful guidelines for the design and construction of next-generation neutron spectrometers.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Response of Simple, Model Systems to Extreme Conditions

The focus of the research was on the application of high-pressure/high-temperature techniques, together with intense energetic ion beams, to the study of the behavior of simple oxide systems (e.g., SiO 2 , GeO 2 , CeO 2 , TiO 2 , HfO 2 , SnO 2 , ZnO and ZrO 2 ) under extreme conditions. These simple stoichiometries provide unique model systems for the analysis of structural responses to pressure up to and above 1 Mbar, temperatures of up to several thousands of kelvin, and the extreme energy density generated by energetic heavy ions (tens of keV/atom). The investigations included systematic studies of radiation- and pressure-induced amorphization of high P-T polymorphs. By studying the response of simple stoichiometries that have multiple structural “outcomes”, we have established the basic knowledge required for the prediction of the response of more complex structures to extreme conditions. We especially focused on the amorphous state and characterized the different non-crystalline structure-types that result from the interplay of radiation and pressure. For such experiments, we made use of recent technological developments, such as the perforated diamond-anvil cell and in situ investigation using synchrotron x-ray sources. We have been particularly interested in using extreme pressures to alter the electronic structure of a solid prior to irradiation. We expected that the effects of modified band structure would be evident in the track structure and morphology, information which is much needed to describe theoretically the fundamental physics of track-formation. Finally, we investigated the behavior of different simple-oxide, composite nanomaterials (e.g., uncoated nanoparticles vs. core/shell systems) under coupled, extreme conditions. This provided insight into surface and boundary effects on phase stability under extreme conditions.

36 MATERIALS SCIENCE↗

Extreme Conditions Modeling Workshop Report

Sandia National Laboratories (SNL) and the National Renewable Energy Laboratory (NREL) hosted the Wave Energy Converter (WEC) Extreme Conditions Modeling (ECM) Workshop in Albuquerque, NM on May 13th-14th, 2014. The objective of the workshop was to review the current state of knowledge on how to model WECs in extreme conditions (e.g. hurricanes and other large storms) and to suggest how U.S. Department of Energy (DOE) and national laboratory resources could be used to improve ECM methods for the benefit of the wave energy industry.

16 TIDAL AND WAVE POWER↗

From atomistic models to machine learning: Predictive design of nanocarbons under extreme conditions

The formation of technologically valuable nanocarbon structures under extreme conditions, such as those produced during high-explosive detonations, remains poorly understood but holds significant potential for the development of controlled synthesis pathways. While detonation shockwaves provide the high-pressure, high-temperature environment required for nanodiamond formation, subsequent cooling and decompression dictate whether the diamond phase is preserved or transformed into other nanocarbon structures. Here, in this study, we employ GPU-accelerated reactive molecular dynamics (ReaxFF) simulations to investigate the graphitization and structural remodeling of detonation nanodiamond under nonlinear quench and pressure-release trajectories. We further investigate how the initial nanodiamond morphology; cuboctahedral, octahedral, or hexagonal prism influences the resulting transformation products. Evolution of nanostructure, allotrope (via simulated x-ray diffraction), carbon hybridization, and ring statistics are tracked during a two-stage quench from 5000 K to 60 GPa. Rapid cooling combined with slow decompression optimizes cubic diamond retention, whereas slow cooling with rapid pressure release promotes surface-to-core graphitization, producing concentric sp 2 -hybridized layers and hollowed inner shells. Octahedral nanodiamonds evolve into carbon nano-onions, initially forming bucky diamonds that progressively transform into fully sp 2 -hybridized structures, while hexagonal prisms preferentially form parallel-stacked graphite layers resembling carbon dots. Transient hexagonal diamond (lonsdaleite) emerges as an interfacial phase, suggesting potential reversibility in the shock-induced graphite-to-diamond transformation pathway transformation route. To extend predictive capabilities, we trained machine learning (ML) regressors on over 10 5 node-hours of molecular dynamics (MD) trajectories. A multilayer perceptron (MLP) model reliably predicts the number of graphitized layers from temperature–pressure trajectories with a coefficient of determination (R 2 ) exceeding 0.90. This high predictive fidelity enables efficient, high-throughput mapping of the synthesis parameter space for optimized graphitization outcomes. Collectively, morphological control combined with optimized quench–decompression conditions promote the selective synthesis of nanocarbon allotropes. This work establishes a data-driven framework for the rational, a priori design of carbon nanomaterials for applications in energy storage, sensing, and biomedicine.

Detonation nanodiamond remodeling↗

The matter in extreme conditions instrument at the Linac Coherent Light Source

The LCLS beam provides revolutionary capabilities for studying the transient behavior of matter in extreme conditions. The particular strength of the Matter in Extreme Conditions instrument is that it combines the unique LCLS beam with high-power optical laser beams, and a suite of dedicated diagnostics tailored for this field of science. In this paper an overview of the beamline, the capabilities of the instrumentation, and selected highlights of experiments and commissioning results are presented.

43 PARTICLE ACCELERATORS↗