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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 559 records · Page 31
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Collider probes of real triplet scalar dark matter

We study discovery prospects for a real triplet extension of the Standard Model scalar sector at the Large Hadron Collider (LHC) and a possible future 100 TeV $\mathcal{pp}$ collider. We focus on the scenario in which the neutral triplet scalar is stable and contributes to the dark matter relic density. When produced in $\mathcal{pp}$ collisions, the charged triplet scalar decays to the neutral component plus a soft pion or soft lepton pair, yielding a disappearing charged track in the detector. We recast current 13 TeV LHC searches for disappearing tracks, and find that the LHC presently excludes a real triplet scalar lighter than 248 (275) GeV, for a mass splitting of 172 (160) MeV with $\mathcal{L}$ = 36 fb –1 . The reach can extend to 497 (520) GeV with the collection of 3000 fb –1 . We extrapolate the 13 TeV analysis to a prospective 100 TeV pp collider, and find that a ~ 3 TeV triplet scalar could be discoverable with $\mathcal{L}$ = 30 ab –1 , depending on the degree to which pile up effects are under control. We also investigate the dark matter candidate in our model and corresponding present and prospective constraints from dark matter direct detection. We find that currently XENON1T can exclude a real triplet dark matter lighter than ~ 3 TeV for a Higgs portal coupling of order one or larger, and the future XENON20T will cover almost the entire dark matter viable parameter space except for vanishingly small portal coupling.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2021

First measurement of large area jet transverse momentum spectra in heavy-ion collisions

Jet production in lead-lead (PbPb) and proton-proton (pp) collisions at a nucleon-nucleon center-of-mass energy of 5.02 TeV is studied with the CMS detector at the LHC, using PbPb and pp data samples corresponding to integrated luminosities of 404 μb$^{−1}$ and 27.4 pb$^{−1}$, respectively. Jets with different areas are reconstructed using the anti-k$_{T}$ algorithm by varying the distance parameter R. The measurements are performed using jets with transverse momenta (p$_{T}$) greater than 200 GeV and in a pseudorapidity range of |η| < 2. To reveal the medium modification of the jet spectra in PbPb collisions, the properly normalized ratio of spectra from PbPb and pp data is used to extract jet nuclear modification factors as functions of the PbPb collision centrality, p$_{T}$ and, for the first time, as a function of R up to 1.0. For the most central collisions, a strong suppression is observed for high-p$_{T}$ jets reconstructed with all distance parameters, implying that a significant amount of jet energy is scattered to large angles. The dependence of jet suppression on R is expected to be sensitive to both the jet energy loss mechanism and the medium response, and so the data are compared to several modern event generators and analytic calculations. The models considered do not fully reproduce the data.[graphic not available: see fulltext]

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2023

Search for Higgs boson decays to a Z boson and a photon in proton-proton collisions at $ \sqrt{s} $ = 13 TeV

Results are presented from a search for the Higgs boson decay H → Zγ, where Z → ℓ$^{+}$ℓ$^{−}$ with ℓ = e or μ. The search is performed using a sample of proton-proton (pp) collision data at a center-of-mass energy of 13 TeV, recorded by the CMS experiment at the LHC, corresponding to an integrated luminosity of 138 fb$^{−1}$. Events are assigned to mutually exclusive categories, which exploit differences in both event topology and kinematics of distinct Higgs production mechanisms to enhance signal sensitivity. The signal strength μ, defined as the product of the cross section and the branching fraction $ \left[\sigma \left(\textrm{pp}\to \textrm{H}\right)\mathcal{B}\left(\textrm{H}\to \textrm{Z}\upgamma \right)\right] $ relative to the standard model prediction, is extracted from a simultaneous fit to the ℓ$^{+}$ℓ$^{−}$γ invariant mass distributions in all categories and is measured to be μ = 2.4 ± 0.9 for a Higgs boson mass of 125.38 GeV. The statistical significance of the observed excess of events is 2.7 standard deviations. This measurement corresponds to $ \left[\sigma \left(\textrm{pp}\to \textrm{H}\right)\mathcal{B}\left(\textrm{H}\to \textrm{Z}\upgamma \right)\right]=0.21\pm 0.08 $ pb. The observed (expected) upper limit at 95% confidence level on μ is 4.1 (1.8), where the expected limit is calculated under the background-only hypothesis. The ratio of branching fractions $ \mathcal{B}\left(\textrm{H}\to \textrm{Z}\upgamma \right)/\mathcal{B}\left(\textrm{H}\to \upgamma \upgamma \right) $ is measured to be $ {1.5}_{-0.6}^{+0.7} $, which agrees with the standard model prediction of 0.69 ± 0.04 at the 1.5 standard deviation level.[graphic not available: see fulltext]

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2025

Measurement of the top-quark pole mass in dileptonic $t\overline{t}$ + 1-jet events at $\sqrt{s}=13$ TeV with the ATLAS experiment

A measurement of the top-quark pole mass $m$$^{pole}_{t}$ is presented in $t\bar{t}$ events with an additional jet, $t\bar{t}$+ 1-jet, produced in pp collisions at $\sqrt{s} = 13 TeV. The data sample, recorded with the ATLAS experiment during Run 2 of the LHC, corresponds to an integrated luminosity of 140 fb −1 . Events with one electron and one muon of opposite electric charge in the final state are selected to measure the $t\bar{t}$ + 1-jet differential cross-section as a function of the inverse of the invariant mass of the $t\bar{t}$ + 1-jet system. Iterative Bayesian Unfolding is used to correct the data to enable comparison with fixed-order calculations at next-to-leading-order accuracy in the strong coupling. The process pp → $t\bar{t}$j(2 → 3), where top quarks are taken as stable particles, and the process pp → $b\bar{b}$l + vl – $\overline{ν}$j (2 → 7), which includes top-quark decays to the dilepton final state and off-shell effects, are considered. The top-quark mass is extracted using a χ 2 fit of the unfolded normalized differential cross-section distribution. The results obtained with the 2 → 3 and 2 → 7 calculations are compatible within theoretical uncertainties, providing an important consistency check.

Hadron-Hadron Scattering↗
DOE OSTI2024

Long coir and glass fiber reinforced polypropylene hybrid composites prepared via wet-laid technique

Natural fiber composites offer an advantage in terms of weight saving for many automotive applications; however, many natural fiber composites lack properties to justify substitution for synthetic composites. Hybridizing the natural fiber composites by adding a fraction of synthetic fibers is an innovative approach to provide a balance between composite's performance and weight savings. In this study, coir fiber (40 wt%)-reinforced polypropylene (PP) composites were hybridized by substituting a fraction of coir fiber with glass fiber (0–30 wt%). The composites were prepared using a novel wet-laid technique followed by compression molding, where the fiber length is preserved. The composites prepared by hybridizing PP/coir fibers with glass fibers were light in weight (6–20% lighter compared to 40 wt% glass fiber reinforced PP) with significantly enhanced tensile (strength – 49–182%, modulus – 54–130%), flexural (strength – 41–104%, modulus – 64–193%), and impact properties (157 - 474%) compared to 40 wt% coir fiber reinforced PP composites. Furthermore, the addition of glass fiber (10–30 wt%) to coir fiber reduced the water-absorbing tendency (by 18–74%) of PP/coir fiber composites. All in all, this work has potential applications in automotive, mass transit, and truck applications where natural fiber composites are being investigated as alternatives to metal and/or fully synthetic composites.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Bisphenol A degradation by manganese oxides at circumneutral pH: Quantitative evaluation of dissolved Mn(III) species with pyrophosphate

Although trivalent manganese (Mn(III)) species have been recognized as crucial intermediates in the degradation of organic contaminants by Mn oxides, quantitative research on their specific roles remains scarce. Here, our study investigated the degradation processes of an organic pollutant, Bisphenol A (BPA), by dissolved Mn(III) and Mn(III)-bearing oxides, and elucidated the differences of the underlying mechanisms and reaction pathways between several Mn oxides and dissolved Mn(III). Our results indicated that BPA degradation rates with Mn(III)-bearing oxides alone follow the order: δ-MnO 2 >> γ-MnOOH > Mn 3 O 4 . Adding pyrophosphate (PP) significantly enhanced BPA degradation by promoting the formation of Mn(III)-PP complexes and exposing more reactive sites, achieved through destabilizing the crystal structure and mitigating of Mn(II) readsorption, particularly in γ-MnOOH and Mn 3 O 4 . Our kinetic model revealed that heterogeneous degradation by Mn oxides is the predominant reaction pathway, accounting for 61.4 %, 87.8 %, and 73.8 % of the total degraded BPA for δ-MnO 2 , γ-MnOOH, and Mn 3 O 4 , respectively, even in the presence of significant amount of dissolved Mn(III) intermediates due to high PP concentrations. These results offer mechanistic details on BPA degradation by Mn oxides and the influence of ligand concentration, providing helpful insights for optimizing degradation strategies of organic pollutants.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2026

Cradle-to-gate life cycle assessment of advanced composite panels incorporating CO 2 -derived multi-walled carbon nanotubes and hemp fiber for sustainable building applications

Advanced composite panels represent a promising pathway to reducing carbon emissions in the construction industry, yet comprehensive environmental impact assessments remain limited. Here, in this study, we conduct a life cycle assessment (LCA) to evaluate the environmental impacts of innovative composite panels produced from multi-walled carbon nanotubes (MWCNTs), hemp fiber (HF), recycled carbon fiber (rCF), and recycled polypropylene (PP), exploring their potential as baseline structural equivalents to conventional gypsum board. MWCNTs and HF play a critical role in sequestering carbon during raw material production, while the recycling processes for CF and PP generally require less energy compared to virgin material production. The LCA evaluates environmental performance using the TRACI 2.1 method, covering global warming potential (GWP), ozone depletion, smog formation, acidification, eutrophication, carcinogenic and non-carcinogenic effects, respiratory impacts, ecotoxicity, and fossil fuel depletion. Compositional variations—resin type (virgin vs. recycled), rCF content (9–29 wt%), and HF content (10–30 wt%)—are introduced for sensitivity and hotspot analyses. Results demonstrate that, when compared on the basis of preliminary structural equivalence, increasing recycled PP, rCF, and HF content can significantly reduce global warming potential compared to gypsum board. Beyond carbon reduction, the composite panels show trade-offs across other environmental categories. With the growing demand for composite materials in interior panels, ceiling systems, and exterior claddings, these findings highlight the environmental benefits and potential trade-offs of the proposed composites, establishing a foundational framework to support their continued development toward full building-system integration.

Advanced composite manufacturing↗
DOE OSTI2022

Enabling a novel approach to a controlled fabrication of 1D crystalline nanowires on suspended microstructures of arbitrary geometries using two direct-writing technologies

Recent progresses in additive manufacturing have inspired new technologies, such as direct laser writing technique, based on two-photon polymerization (2 PP), which complements and further enriches the nanofabrication tools portfolio. Here, we combine 2 PP and our mask-free scanning probe assisted ‘direct-write patterning’ (DWP) method to allow for: a) the fabrication of micro-bridge structures with sub-micrometer resolution, b) selective synthesis of crystalline ZnO nanowires at predefined locations, respectively. This synergistic approach enables cantilever probe patterning of catalysts directly on suspended micro-bridges for in-situ CVD growth of nanoscale material, in a templated manner. The study reported here represents the first proof-of-concept experiments demonstrating versatile and scalable methodology, which can be applied and straightforwardly extended to grow a variety of other nanomaterials, in a controlled and selective fashion, on freestanding micro/nanoscale structures, whose size and geometry can be conveniently varied via templating of sacrificial 2 PP polymeric scaffolds. Furthermore, the demonstration of the possibility to integrate this new approach with the conventional lithography techniques provides a step forward to the development of the novel class of hybrid polymer-silicon-1D or -2D materials, and systems. The quality of the produced ZnO nanowire assemblies was assessed using several physical characterization methods.

36 MATERIALS SCIENCE↗
DOE OSTI2022

Measurement of the nuclear modification factor for muons from charm and bottom hadrons in Pb+Pb collisions at 5.02 TeV with the ATLAS detector

Heavy-flavour hadron production provides information about the transport properties and microscopic structure of the quark–gluon plasma created in ultra-relativistic heavy-ion collisions. A measurement of the muons from semileptonic decays of charm and bottom hadrons produced in Pb+Pb and pp collisions at a nucleon–nucleon centre-of-mass energy of 5.02 TeV with the ATLAS detector at the Large Hadron Collider is presented. The Pb+Pb data were collected in 2015 and 2018 with sampled integrated luminosities of 208 μb –1 and 38 μb –1 , respectively, and pp data with a sampled integrated luminosity of 1.17 pb –1 were collected in 2017. Muons from heavy-flavour semileptonic decays are separated from the light-flavour hadronic background using the momentum imbalance between the inner detector and muon spectrometer measurements, and muons originating from charm and bottom decays are further separated via the muon track's transverse impact parameter. Differential yields in Pb+Pb collisions and differential cross sections in pp collisions for such muons are measured as a function of muon transverse momentum from 4 GeV to 30 GeV in the absolute pseudorapidity interval |n| < 2. Nuclear modification factors for charm and bottom muons are presented as a function of muon transverse momentum in intervals of Pb+Pb collision centrality. The bottom muon results are the most precise measurement of b quark nuclear modification at low transverse momentum where reconstruction of B hadrons is challenging. The measured nuclear modification factors quantify a significant suppression of the yields of muons from decays of charm and bottom hadrons, with stronger effects for muons from charm hadron decays.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2023

Comparison of inclusive and photon-tagged jet suppression in 5.02 TeV Pb+Pb collisions with ATLAS

Parton energy loss in the quark–gluon plasma (QGP) is studied with a measurement of photon-tagged jet production in 1.7 nb –1 of Pb+Pb data and 260 pb –1 of pp data, both at $\sqrt{^S{\text{NN}}}$ = 5.02 TeV, with the ATLAS detector. The process $pp$ → γ +jet+X and its analogue in Pb+Pb collisions is measured in events containing an isolated photon with transverse momentum ($p_{\text{T}}$) above 50 GeV and reported as a function of jet $p_{\text{T}}$. This selection results in a sample of jets with a steeply falling $p_{\text{T}}$ distribution that are mostly initiated by the showering of quarks. The $pp$ and Pb+Pb measurements are used to report the nuclear modification factor, $R_{\text{AA}}$, and the fractional energy loss, $S_{\text{loss}}$, for photon-tagged jets. In addition, the results are compared with the analogous ones for inclusive jets, which have a significantly smaller quark-initiated fraction. The $R_{\text{AA}}$ and $S_{\text{loss}}$ values are found to be significantly different between those for photon-tagged jets and inclusive jets, demonstrating that energy loss in the QGP is sensitive to the colour-charge of the initiating parton. Finally, the results are also compared with a variety of theoretical models of colour-charge-dependent energy loss.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Skewness and kurtosis of mean transverse momentum fluctuations at the LHC energies

The first measurements of skewness and kurtosis of mean transverse momentum ($\langle$$p_T\rangle$) fluctuations are reported in Pb–Pb collisions at $\sqrt{s_{NN}}$ = 5.02 TeV, Xe–Xe collisions at $\sqrt{s_{NN}}$ = 5.44 TeV and pp collisions at $\sqrt{s}$ = 5.02 TeV using the ALICE detector. The measurements are carried out as a function of system size $\langle$dN ch /dη$\rangle$$^{1/3}_{|η|<0.5}$, using charged particles with transverse momentum ($p_T$) and pseudorapidity (η), in the range 0.2<$p_T$<3.0 GeV/c and |η|<0.8, respectively. In Pb–Pb and Xe–Xe collisions, positive skewness is observed in the fluctuations of $\langle$$p_T\rangle$ for all centralities, which is significantly larger than what would be expected in the scenario of independent particle emission. This positive skewness is considered a crucial consequence of the hydrodynamic evolution of the hot and dense nuclear matter created in heavy-ion collisions. Furthermore, similar observations of positive skewness for minimum bias pp collisions are also reported here. Kurtosis of $\langle$$p_T\rangle$ fluctuations is found to be in good agreement with the kurtosis of Gaussian distribution, for most central Pb–Pb collisions. Hydrodynamic model calculations with MUSIC using Monte Carlo Glauber initial conditions are able to explain the measurements of both skewness and kurtosis qualitatively from semicentral to central collisions in Pb–Pb system. Color reconnection mechanism in PYTHIA8 model seems to play a pivotal role in capturing the qualitative behavior of the same measurements in pp collisions.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2025

Evidence of medium response to hard probes using correlations of Z bosons with hadrons in heavy ion collisions

The first measurement of pseudorapidity and azimuthal angle distributions relative to the momentum vector of a Z boson for low transverse momentum ($p_\mathrm{T}$) charged hadrons in lead-lead (PbPb) collisions is presented. By studying the hadrons produced in an event with a high-$p_\mathrm{T}$ Z boson (40 $\lt$ $p_\mathrm{T}$ $\lt$ 350 GeV), the analysis probes how the quark-gluon plasma (QGP) medium created in these collisions affects the parton recoiling opposite to the Z boson. Utilizing PbPb data at a nucleon-nucleon center-of-mass energy $\sqrt{s_{_\mathrm{NN}}}$ = 5.02 TeV from 2018 with an integrated luminosity of 1.67 nb$^{-1}$ and proton-proton (pp) data at the same energy from 2017 with 301 pb$^{-1}$, the distributions are examined in bins of charged-hadron $p_\mathrm{T}$. A significant modification of the distributions for charged hadrons in the range 1 $\lt$ $p_\mathrm{T}$ $\lt$ 2 GeV in PbPb collisions is observed when compared to reference measurements from pp collisions. The data provide new information about the correlation between hard and soft particles in heavy ion collisions, which can be used to test predictions of various jet quenching models. The results are consistent with expectations of a hydrodynamic wake created when the QGP is depleted of energy by the parton propagating through it. Based on comparisons of PbPb data with pp references and predictions from theoretical models, this Letter presents the first evidence of medium-recoil and medium-hole effects caused by a hard probe.

CMS↗
DOE OSTI2023

Simultaneous measurements of kinetic and scalar energy spectrum time evolution in the Richtmyer–Meshkov instability upon reshock

The Richtmyer–Meshkov instability (Richtmyer, Commun. Pure Appl. Maths , vol. 13, issue 2, 1960, pp. 297–319; Meshkov, Fluid Dyn. , vol. 4, issue 5, 1972, pp. 101–104) of a twice-shocked gas interface is studied using both high spatial resolution single-shot (SS) and lower spatial resolution, time-resolved, high-speed (HS) simultaneous planar laser-induced fluorescence and particle image velocimetry in the Wisconsin Shock Tube Laboratory's vertical shock tube. The initial condition (IC) is a shear layer with broadband diffuse perturbations at the interface between a helium–acetone mixture and argon. This IC is accelerated by a shock of nominal strength Mach number $M = 1.75$ , and then accelerated again by the transmitted shock that reflects off the end wall of the tube. An ensemble of experiments is analysed after reshock while the interface mixing width grows linearly with time. The kinetic and scalar energy spectra and the terms of their evolution equation are calculated and compared between SS and HS experiments. The inertial range scaling of the scalar power spectrum is found to follow Gibson's relation (Gibson, Phys. Fluids , vol. 11, issue 11, 1968, pp. 2316–2327) as a function of Schmidt number when the effective turbulent Schmidt number is used in place of the material Schmidt number that controls equilibrium scaling. Further, the spatially integrated scalar flux follows similar behaviour observed for the kinetic energy in large eddy simulation studies by Zeng et al. ( Phys. Fluids , vol. 30, issue 6, 2018, 064106) while the spatially varying scalar flux exhibits back scatter along the centre of the mixing layer and forward energy transfer in the spike and bubble regions.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2020

Collisional effects on resonant particles in quasilinear theory

A careful examination of the effects of collisions on resonant wave–particle interactions leads to an alternate interpretation and deeper understanding of the quasilinear operator originally formulated by Kennel & Engelmann ( Phys. Fluids , vol. 9, 1966, pp. 2377–2388) for collisionless, magnetized plasmas, and widely used to model radio frequency heating and current drive. The resonant and nearly resonant particles are particularly sensitive to collisions that scatter them out of and into resonance, as for Landau damping as shown by Johnston ( Phys. Fluids , vol. 14, 1971, pp. 2719–2726) and Auerbach ( Phys. Fluids , vol. 20, 1977, pp. 1836–1844). As a result, the resonant particle–wave interactions occur in the centre of a narrow collisional boundary when the collision frequency $\unicode[STIX]{x1D708}$ is very small compared to the wave frequency $\unicode[STIX]{x1D714}$ . The diffusive nature of the pitch angle scattering combined with the wave–particle resonance condition enhances the collision frequency by $(\unicode[STIX]{x1D714}/\unicode[STIX]{x1D708})^{2/3}\gg 1$ , resulting in an effective resonant particle collisional interaction time of $\unicode[STIX]{x1D70F}_{\text{int}}\sim (\unicode[STIX]{x1D708}/\unicode[STIX]{x1D714})^{2/3}/\unicode[STIX]{x1D708}\ll 1/\unicode[STIX]{x1D708}$ . A collisional boundary layer analysis generalizes the standard quasilinear operator to a form that is fully consistent with Kennel–Englemann, but allows replacing the delta function appearing in the diffusivity with a simple integral (having the appropriate delta function limit) retaining the new physics associated with the narrow boundary layer, while preserving the entropy production principle. The limitations of the collisional boundary layer treatment are also estimated, and indicate that substantial departures from Maxwellian are not permitted.

Physics↗
DOE OSTI2021

An adjoint method for determining the sensitivity of island size to magnetic field variations

An adjoint method to calculate the gradient of island width in stellarators is presented and applied to a set of magnetic field configurations. The underlying method for calculation of the island width is that of Cary & Hanson ( Phys. Fluids B, vol. 3, issue 4, 1991, pp. 1006–1014) (with a minor modification), and requires that the residue of the island centre be small. Therefore, the gradient of the residue is calculated in addition. Both the island width and the gradient calculations are verified using an analytical magnetic field configuration introduced by Reiman & Greenside ( Comput. Phys. Commun. , vol. 43, issue 1, 1986, pp. 157–167). The method is also applied to the calculation of the shape gradient of the width of a magnetic island in a National Compact Stellarator Experiment (NCSX) vacuum configuration with respect to positions on a coil. A gradient-based optimization is applied to a magnetic field configuration studied by Hanson & Cary ( Phys. Fluids , vol. 27, issue 4, 1984, pp. 767–769) to minimize stochasticity by adding perturbations to a pair of helical coils. Although only vacuum magnetic fields and an analytical magnetic field model are considered in this work, the adjoint calculation of the island width gradient could also be applied to a magnetohydrodynamic (MHD) equilibrium if the derivative of the magnetic field, with respect to the equilibrium parameters, is known. Using the island width gradient calculation presented here, more general gradient-based optimization methods can be applied to design stellarators with small magnetic islands. Moreover, the sensitivity of the island size may itself be optimized to ensure that coil tolerances, with respect to island size, are kept as high as possible.

Physics↗
DOE OSTI2025

Bootstrap current modeling in M3D-C1

Bootstrap current plays a crucial role in the equilibrium of magnetically confined plasmas, particularly in quasi-symmetric stellarators and in tokamaks, where it can represent bulk of the electric current density. Accurate modeling of this current is essential for understanding the magnetohydrodynamic (MHD) equilibrium and stability of these configurations. This study expands the modeling capabilities of M3D-C1, an extended-MHD code, by implementing self-consistent physics models for bootstrap current. It employs two analytical frameworks: a generalized Sauter model (Sauter et al. 1999 Phys. Plasmas vol. 6, no. 7, pp. 2834–2839), and a revised Sauter-like model (Redl et al. 2021 Phys. Plasmas vol. 28, no. 2, pp. 022502). The isomorphism described by Landreman et al. (2022 Phys. Rev. Lett. vol. 128, pp. 035001) is employed to apply these models to quasi-symmetric stellarators. The implementation in M3D-C1 is benchmarked against neoclassical codes, including NEO, XGCa and SFINCS, showing excellent agreement. These improvements allow M3D-C1 to self-consistently calculate the neoclassical contributions to plasma current in axisymmetric and quasi-symmetric configurations, providing a more accurate representation of the plasma behavior in these configurations. A workflow for evaluating the neoclassical transport using SFINCS with arbitrary toroidal equilibria calculated using M3D-C1 is also presented. This workflow enables a quantitative evaluation of the error in the Sauter-like model in cases that deviate from axi- or quasi-symmetry (e.g. through the development of an MHD instability).

fusion plasma↗
DOE OSTI2026

Effect of Radical Initiators on Polypropylene Thermal Deconstruction

A new route for polypropylene (PP) deconstruction through radical pathways based on thermodynamic and kinetic considerations has been investigated. Radical polypropylene (PP) deconstruction, activated through small quantities of initiators, can enable the deconstruction of waste POs into unsaturated products. We found that stirring was detrimental to the β-scission extent because it accelerates radical termination reactions through mixing. The best results were achieved by using a semibatch process that included mechanical mixing during the temperature ramp, static heating of the polymer/initiator mixture at the final temperature, and volatile product removal with N 2 . Dicumyl peroxide and alkylated dicumene initiators produced similar liquid and solid products after a 30 min thermal treatment. Terminal alkenes were formed in the liquid products of reactions at 375 and 400 °C, with about 5% of the protons in the liquid product ascribed to terminal alkenes. Yields of liquid products increased with temperature, reaching 60% w/w at 400 °C; at the same time, yields of solid products decreased with temperature to 16% w/w at 400 °C. Although radical initiators decrease PP molecular weight during the temperature ramp, at 400 °C, initiators only marginally increased the liquid product fraction compared to control experiments. Finally, the terminal double bonds in the liquid product mixture (C8–C36) provide multiple pathways for upgrading to surfactants, plasticizers, lube oils, and other valuable products.

liquids↗
DOE OSTI2021

Prediction of Solution Behavior via Calorimetric Measurements Allows for Detailed Elucidation of Polyoxometalate Transformation

The solution behavior of a polyoxometalate cluster, LiNa-U 24 Pp 12 (Li 24 Na 24 [(UO 2 O 2 ) 24 (P 2 O 7 ) 12 ]) that consists of 24 uranyl ions, peroxide groups, and 12 pyrophosphate linkers, was successfully predicted based on new thermodynamic results using a calorimetric method recently described for uranyl peroxide nanoclusters (UPCs), molybdenum blues, and molybdenum browns. The breakdown of LiNa-U 24 Pp 12 and formation of U 24 (Li 24 [UO 2 O 2 OH] 24 ) was monitored in situ via Raman spectroscopy using a custom heating apparatus. A combination of analytical techniques confirmed the simultaneous existence of U 24 Pp 12 and U 24 midway through the conversion process and U 24 as the single end product. The application of a molecular weight filter resulted in a complete and successful separation of UPCs from solution and, in conjunction with DOSY results, confirmed the presence of large intermediate cluster building blocks.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗