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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 379 records · Page 21
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

Static and Dynamic Gradient Based Directional Transportation of Neutral Molecules in Swollen Polymer Films

Abstract Materials which selectively transport molecules offer powerful opportunities for concentrating and separating chemical agents. Here, utilizing static and dynamic chemical gradients, transport of molecules within swollen crosslinked polymers is demonstrated. Using an ≈200 μm static hydroxyl to hexyl gradient, the neutral ambipolar nerve agent surrogate diethyl (cyanomethyl)phosphonate (DECP) is directionally transported and concentrated 60‐fold within 4 hours. To accelerate transport kinetics, a dynamic gradient (a “travelling wave”) is utilized. Here, the non‐polar dye pyrene was transported. The dynamic gradient is generated by an ion exchange process triggered by the localized introduction of an aqueous NaCl solution, which converts the gel from hydrophobic to hydrophilic. As the hydrophilic region expands, associated water enters the gel, and pyrene is pushed ahead of the expansion front. The dynamic gradient provides about 10‐fold faster transport kinetics than the static gradient.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Spin‐State and Clustering Effects in Fe‐Complex Negolytes for Near‐Neutral Aqueous Redox Flow Batteries

Cost-effective redox-active materials are essential for advancing redox flow batteries (RFBs). Iron, with its abundance and suitability as a redox couple, is a promising candidate; however, achieving stable and fast redox reactions in aqueous RFBs remains a challenge. Here, this study presents an Fe-based negolyte stabilized by a hexadentate ligand, where Fe–ligand bonds are enhanced through intermolecular interactions. The sulfonate-substituted Fe complex exhibits a formal potential of −0.44 V versus Ag/AgCl and an exceptionally high rate constant of 0.69 cm s −1 . Near-neutral RFBs incorporating 0.5 M Fe complex show excellent cycling stability, with no discernible capacity fading over 300 cycles. This performance is attributed to intermolecular hydrogen bonds that reinforce Fe–ligand coordination and promote the formation of stable trimeric clusters. Operando electrochemical Raman spectroscopy and density functional theory reveal that π-backdonation from Fe(II) to the imino-phenolate moiety further stabilizes the complex after reduction. In contrast, the hydroxyl-substituted complex exhibits inferior stability due to weaker hydrogen bonding and less pronounced π-backdonation. These findings underscore the importance of ligand design and intermolecular interactions in developing cost-effective, high-performance redox-active materials for aqueous RFBs.

36 MATERIALS SCIENCE↗
DOE OSTI2022

Influence of the complete basis set approximation, tight weighted-core, and diffuse functions on the DLPNO-CCSD(T1) atomization energies of neutral H,C,O-compounds

The impact of complete basis set extrapolation schemes (CBS), diffuse functions, and tight weighted core functions on enthalpies of formation predicted via the DLPNO-CCSD(T1) reduced Feller Peterson-Dixon approach has been examined for neutral H,C,O-compounds. All tested three-point (TZ/QZ/5Z) extrapolation schemes result in mean unsigned deviation (MUD) below 2 kJ mol -1 relative to the experiment. Here, the two-point QZ/5Z and TZ/QZ CBS 1/$l^3_{max}$ extrapolation schemes are inferior to their inverse power counterpart (1/($l_{max}$ + 1/2) 4 ) by 1.3 and 4.3 kJ mol -1 . The CBS extrapolated frozen core atomization energies are insensitive (within 1 kJ mol -1 ) to augmentation of the basis set with tight weighted core functions. The core-valence correlation effects converge already at triple-ζ, although double- ζ/triple- ζ CBS extrapolation performs better and is recommended. The effect of diffuse function augmentation converges slowly, and cannot be reproduced with double- ζ or triple- ζ calculations as these are plagued with basis set superposition and incompleteness errors.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2020

Multimodel validation of single wakes in neutral and stratified atmospheric conditions

Previous research has revealed the need for a validation study that considers several wake quantities and code types so that decisions on the trade-off between accuracy and computational cost can be well informed and appropriate to the intended application. In addition to guiding code choice and setup, rigorous model validation exercises are needed to identify weaknesses and strengths of specific models and guide future improvements. Here, we consider 13 approaches to simulating wakes observed with a nacelle-mounted lidar at the Scaled Wind Technology Facility (SWiFT) under varying atmospheric conditions. We find that some of the main challenges in wind turbine wake modeling are related to simulating the inflow. In the neutral benchmark, model performance tracked as expected with model fidelity, with large-eddy simulations performing the best. In the more challenging stable case, steady-state Reynolds-averaged Navier–Stokes simulations were found to outperform other model alternatives because they provide the ability to more easily prescribe noncanonical inflows and their low cost allows for simulations to be repeated as needed. Dynamic measurements were only available for the unstable benchmark at a single downstream distance. These dynamic analyses revealed that differences in the performance of time-stepping models come largely from differences in wake meandering. This highlights the need for more validation exercises that take into account wake dynamics and are able to identify where these differences come from: mesh setup, inflow, turbulence models, or wake-meandering parameterizations. In addition to model validation findings, we summarize lessons learned and provide recommendations for future benchmark exercises.

17 WIND ENERGY↗
DOE OSTI2025

Search for long-lived heavy neutral leptons in proton-proton collision events with a lepton-jet pair associated with a secondary vertex at $\sqrt{s}$ = 13 TeV

A search for long-lived heavy neutral leptons (HNLs) using proton-proton collision data corresponding to an integrated luminosity of 138 fb −1 collected at $\sqrt{s}$ = 13 TeV with the CMS detector at the CERN LHC is presented. Events are selected with a charged lepton originating from the primary vertex associated with the proton-proton interaction, as well as a second charged lepton and a hadronic jet associated with a secondary vertex that corresponds to the semileptonic decay of a long-lived HNL. No excess of events above the standard model expectation is observed. Exclusion limits at 95% confidence level are evaluated for HNLs that mix with electron and/or muon neutrinos. Limits are presented in the mass range of 1–16.5 GeV, with excluded square mixing parameter values reaching as low as 2 × 10 −7 . For masses above 11 GeV, the presented limits exceed all previous results in the semileptonic decay channel, and for some of the considered scenarios are the strongest to date.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2020

Search for lepton flavour violating decays of a neutral heavy Higgs boson to $\mu\tau$ and e$\tau$ in proton-proton collisions at $\sqrt{s}=$ 13 TeV

A search for lepton flavour violating decays of a neutral non-standard-model Higgs boson in the μτ and eτ decay modes is presented. The search is based on proton-proton collisions at a center of mass energy $ \sqrt{s} $ = 13 TeV collected with the CMS detector in 2016, corresponding to an integrated luminosity of 35.9 fb$^{−1}$. The τ leptons are reconstructed in the leptonic and hadronic decay modes. No signal is observed in the mass range 200–900 GeV. At 95% confidence level, the observed (expected) upper limits on the production cross section multiplied by the branching fraction vary from 51.9 (57.4) fb to 1.6 (2.1) fb for the μτ and from 94.1 (91.6) fb to 2.3 (2.3) fb for the eτ decay modes.[graphic not available: see fulltext]

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2023

Heavy neutral leptons at the Electron-Ion Collider

The future Electron-Ion Collider (EIC) at Brookhaven National Laboratory, along with its primary capacity to elucidate the nuclear structure, will offer new opportunities to probe physics beyond the Standard Model coupled to the electroweak sector. Among the best motivated examples of such new physics are new heavy neutral leptons (HNLs), which are likely to play a key role in neutrino mass generation and lepton number violation. We study the capability of the EIC to search for HNLs, which can be produced in electron- proton collisions through charged current interactions as a consequence of their mixing with light neutrinos. We find that, with the EIC design energy and integrated luminosity, one is able to probe HNLs in the mass range of 1 – 100 GeV with mixing angles down to the order of 10 -4 - 10 -3 through the prompt decay signatures, and in the mass range of 1 10 GeV with |U e | 2 ~ 10 -6 - 10 -4 via the displaced decay signatures. We also consider the invisible mode where an HNL is undetected or decaying to dark sector particles. One could potentially probe heavy HNLs for mixing angles in the window 10 -3 - 10 -2 , provided SM background systematics can be brought under control. These searches are complementary to other probes of HNLs, such as neutrino-less double-β decay, meson decay, fixed-target, and high-energy collider experiments.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2023

Heavy neutral leptons at muon colliders

The future high-energy muon colliders, featuring both high energy and low background, could play a critical role in our searches for new physics. The smallness of neutrino mass is a puzzle of particle physics. Broad classes of solutions to the neutrino puzzles can be best tested by seeking the partners of SM light neutrinos, dubbed as heavy neutral leptons (HNLs), at muon colliders. We can parametrize HNLs in terms of the mass m N and the mixing angle with ℓ-flavor U ℓ . In this work, we focus on the regime m N > O(100) GeV and study the projected sensitivities on the |U ℓ | 2 – m N plane with the full-reconstructable HNL decay into a hadronic W and a charged lepton. The projected reach in |U ℓ | 2 leads to the best sensitivities in the TeV realm.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Search for Long-Lived Heavy Neutral Leptons with Lepton Flavour Conserving or Violating Decays to a Jet and a Charged Lepton

A search for long-lived heavy neutral leptons (HNLs) is presented, which considers the hadronic final state and coupling scenarios involving all three lepton generations in the 2–20 GeV HNL mass range for the first time. Events comprising two leptons (electrons or muons) and jets are analyzed in a data sample of proton-proton collisions, recorded with the CMS experiment at the CERN LHC at a centre-of-mass energy of 13 TeV, corresponding to an integrated luminosity of 138 fb$^{−1}$. A novel jet tagger, based on a deep neural network, has been developed to identify jets from an HNL decay using various features of the jet and its constituent particles. The network output can be used as a powerful discriminating tool to probe a broad range of HNL lifetimes and masses. Contributions from background processes are determined from data. No excess of events in data over the expected background is observed. Upper limits on the HNL production cross section are derived as functions of the HNL mass and the three coupling strengths V$_{ℓN}$ to each lepton generation ℓ and presented as exclusion limits in the coupling-mass plane, as lower limits on the HNL lifetime, and on the HNL mass. In this search, the most stringent limit on the coupling strength is obtained for pure muon coupling scenarios; values of |$ {V}_{\mu \textrm{N}}^2 $| > 5 (4) × 10$^{−7}$ are excluded for Dirac (Majorana) HNLs with a mass of 10 GeV at a confidence level of 95% that correspond to proper decay lengths of 17 (10) mm.[graphic not available: see fulltext]

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2023

Heavy neutral leptons at beam dump experiments of future lepton colliders

A new beam dump experiment that utilizes the beam of future high energy electron-positron colliders could be an excellent avenue to search for dark sector particles due to its unprecedented high energy and intensity. We consider heavy neutral leptons (HNLs) as a specific example to demonstrate the sensitivity of searches for dark sector particles at future electron-positron collider beam dump experiments. This includes the study of the reach at the International Linear Collider (ILC), the Cool Copper Collider (C 3 ), and the Compact Linear Collider (CLIC). We comprehensively examine the HNL production and detector acceptance at these electron beam dump experiments. We show that these experiments will probe regions of HNL parameter space, not yet probed by past experiments, as well as by future approved experiments. Our study also motivates a more detailed analysis of heavy meson productions in high-energy electron-nucleon collisions in thick targets.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2021

Dark scalars and heavy neutral leptons at DarkQuest

The proposed DarkQuest beam dump experiment, a modest upgrade to the existing SeaQuest/SpinQuest experiment, has great potential for uncovering new physics within a dark sector. We explore both the near-term and long-term prospects for observing two distinct, highly-motivated hidden sector benchmark models: heavy neutral leptons and Higgs-mixed scalars. We comprehensively examine the particle production and detector acceptance at DarkQuest, including an updated treatment of meson production, and light scalar production through both bremsstrahlung and gluon-gluon fusion. In both benchmark models, DarkQuest will provide an opportunity to probe previously inaccessible interesting regions of parameter space on a fairly short timescale when compared to other proposed experiments.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2020

2HDM neutral scalars under the LHC

Two Higgs Doublet Models (2HDM) provide a simple framework for new physics models with an extended Higgs sector. The current LHC results, including both direct searches for additional non-Standard Model (SM) Higgs bosons, as well as precision measurements of the SM-like Higgs couplings, already provide strong constraints on the 2HDM parameter spaces. In this paper, we examine those constraints for the neutral scalars in the Type-I and Type-II 2HDM. In addition to the direct search channels with SM final states: H/A → ff¯¯¯, VV, Vh, hh, we study in particular the exotic decay channels of H/A → AZ/HZ once there is a mass hierarchy between the non-SM Higgses. We found that H/A → AZ/H Z channel has unique sensitivity to the alignment limit region which remains unconstrained by conventional searches and Higgs precision measurements. This mode also extends the reach at intermediate tβ for heavy mA that are not covered by the other direct searches.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2022

Search for neutral long-lived particles in pp collisions at $$ \sqrt{s} $$ = 13 TeV that decay into displaced hadronic jets in the ATLAS calorimeter

A search for decays of pair-produced neutral long-lived particles (LLPs) is presented using 139 fb - 1 of proton-proton collision data collected by the ATLAS detector at the LHC in 2015–2018 at a centre-of-mass energy of 13 TeV. Dedicated techniques were developed for the reconstruction of displaced jets produced by LLPs decaying hadronically in the ATLAS hadronic calorimeter. Two search regions are defined for different LLP kinematic regimes. The observed numbers of events are consistent with the expected background, and limits for several benchmark signals are determined. For a SM Higgs boson with a mass of 125 GeV, branching ratios above 10% are excluded at 95% confidence level for values of c times LLP mean proper lifetime in the range between 20 mm and 10 m depending on the model. Upper limits are also set on the cross-section times branching ratio for scalars with a mass of 60 GeV and for masses between 200 GeV and 1 TeV.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2023

Search for light long-lived neutral particles that decay to collimated pairs of leptons or light hadrons in $pp$ collisions at $\sqrt{s}$ = 13 TeV with the ATLAS detector

A search for light long-lived neutral particles with masses in the O(MeV–GeV) range is presented. The analysis targets the production of long-lived dark photons in the decay of a Higgs boson produced via gluon–gluon fusion or in association with a W boson. Events that contain displaced collimated Standard Model fermions reconstructed in the calorimeter or muon spectrometer are selected in 139 fb -1 of $\sqrt{s}$ = 13 TeV $pp$ collision data collected by the ATLAS detector at the LHC. Background estimates for contributions from Standard Model processes and instrumental effects are extracted from data. The observed event yields are consistent with the expected background. Exclusion limits are reported on the production cross-section times branching fraction as a function of the mean proper decay length cτ of the dark photon, or as a function of the dark-photon mass and kinetic mixing parameter that quantifies the coupling between the Standard Model and potential hidden (dark) sectors. A Higgs boson branching fraction above 1% is excluded at 95% CL for a Higgs boson decaying into two dark photons for dark-photon mean proper decay lengths between 10 mm and 250 mm and dark photons with masses between 0.4 GeV and 2 GeV.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Search for heavy neutral leptons in final states with electrons, muons, and hadronically decaying tau leptons in proton-proton collisions at $ \sqrt{s} $ = 13 TeV

A search for heavy neutral leptons (HNLs) of Majorana or Dirac type using proton-proton collision data at $ \sqrt{s} $ = 13 TeV is presented. The data were collected by the CMS experiment at the CERN LHC and correspond to an integrated luminosity of 138 fb$^{−1}$. Events with three charged leptons (electrons, muons, and hadronically decaying tau leptons) are selected, corresponding to HNL production in association with a charged lepton and decay of the HNL to two charged leptons and a standard model (SM) neutrino. The search is performed for HNL masses between 10 GeV and 1.5 TeV. No evidence for an HNL signal is observed in data. Upper limits at 95% confidence level are found for the squared coupling strength of the HNL to SM neutrinos, considering exclusive coupling of the HNL to a single SM neutrino generation, for both Majorana and Dirac HNLs. The limits exceed previously achieved experimental constraints for a wide range of HNL masses, and the limits on tau neutrino coupling scenarios with HNL masses above the W boson mass are presented for the first time.[graphic not available: see fulltext]

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2022

Search for long-lived heavy neutral leptons with displaced vertices in proton-proton collisions at $\sqrt{\mathrm{s}}$ =13 TeV

A search for heavy neutral leptons (HNLs), the right-handed Dirac or Majorana neutrinos, is performed in final states with three charged leptons (electrons or muons) using proton-proton collision data collected by the CMS experiment at √s = 13 TeV at the CERN LHC. The data correspond to an integrated luminosity of 138 fb -1 . The HNLs could be produced through mixing with standard model neutrinos ν. For small values of the HNL mass (<20 GeV) and the square of the HNL-ν mixing parameter (10 -7 –10 -2 ), the decay length of these particles can be large enough so that the secondary vertex of the HNL decay can be resolved with the CMS silicon tracker. The selected final state consists of one lepton emerging from the primary proton-proton collision vertex, and two leptons forming a displaced, secondary vertex. No significant deviations from the standard model expectations are observed, and constraints are obtained on the HNL mass and coupling strength parameters, excluding previously unexplored regions of parameter space in the mass range 1–20 GeV and squared mixing parameter values as low as 10 -7 .

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2023

Search for a new scalar resonance in flavour-changing neutral-current top-quark decays $t → qX (q = u, c)$, with $X → b\overline{b} $, in proton-proton collisions at $ \sqrt{s} $ = 13 TeV with the ATLAS detector

A search for flavour-changing neutral-current decays of a top quark into an up-type quark (either up or charm) and a light scalar particle X decaying into a bottom anti-bottom quark pair is presented. The search focuses on top-quark pair production where one top quark decays to qX, with X → $b\bar{b}$, and the other top quark decays according to the Standard Model, with the W boson decaying leptonically. The final state is thus characterised by an isolated electron or muon and at least four jets. Events are categorised according to the multiplicity of jets and jets tagged as originating from b-quarks, and a neural network is used to discriminate between signal and background processes. The data analysed correspond to 139 fb –1 of proton–proton collisions at a centre-of-mass energy of 13 TeV, recorded with the ATLAS detector at the LHC. The 95% confidence-level upper limits between 0.019% and 0.062% are derived for the branching fraction $\mathcal{B}$(t → uX) and between 0.018% and 0.078% for the branching fraction $\mathcal{B}$(t → cX), for masses of the scalar particle X between 20 and 160 GeV.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2025

Search for heavy neutral leptons in decays of W bosons using leptonic and semi-leptonic displaced vertices in $\sqrt{s}$ = 13 TeV pp collisions with the ATLAS detector

A search is performed for long-lived heavy neutral leptons (HNLs), produced through the decay of a W boson along with a muon or electron. Two channels are explored: a leptonic channel, in which the HNL decays into two leptons and a neutrino, and a semi-leptonic channel, in which the HNL decays into a lepton and a charged pion. The search is performed with 140 fb −1 of $\sqrt{s}$ = 13 TeV proton-proton collision data collected by ATLAS during Run 2 of the Large Hadron Collider. No excess of events is observed; Dirac-like and Majorana-like HNLs with masses below 14.5 GeV and mixing coefficients as small as 10 −7 are excluded at the 95% confidence level. The results are interpreted under different assumptions on the flavour of the leptons from the HNL decays.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗