Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “coupling constant”

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.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 91 records · Page 5

FLAG Review 2021

Abstract We review lattice results related to pion, kaon, D -meson, B -meson, and nucleon physics with the aim of making them easily accessible to the nuclear and particle physics communities. More specifically, we report on the determination of the light-quark masses, the form factor $$f_+(0)$$ f + ( 0 ) arising in the semileptonic $$K \rightarrow \pi $$ K → π transition at zero momentum transfer, as well as the decay constant ratio $$f_K/f_\pi $$ f K / f π and its consequences for the CKM matrix elements $$V_{us}$$ V us and $$V_{ud}$$ V ud . Furthermore, we describe the results obtained on the lattice for some of the low-energy constants of $$SU(2)_L\times SU(2)_R$$ S U ( 2 ) L × S U ( 2 ) R and $$SU(3)_L\times SU(3)_R$$ S U ( 3 ) L × S U ( 3 ) R Chiral Perturbation Theory. We review the determination of the $$B_K$$ B K parameter of neutral kaon mixing as well as the additional four B parameters that arise in theories of physics beyond the Standard Model. For the heavy-quark sector, we provide results for $$m_c$$ m c and $$m_b$$ m b as well as those for the decay constants, form factors, and mixing parameters of charmed and bottom mesons and baryons. These are the heavy-quark quantities most relevant for the determination of CKM matrix elements and the global CKM unitarity-triangle fit. We review the status of lattice determinations of the strong coupling constant $$\alpha _s$$ α s . We consider nucleon matrix elements, and review the determinations of the axial, scalar and tensor bilinears, both isovector and flavor diagonal. Finally, in this review we have added a new section reviewing determinations of scale-setting quantities.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Lepton-pair production at hadron colliders at N 3 LO in QCD

We compute for the first time the complete corrections at N 3 LO in the strong coupling constant to the inclusive neutral-current Drell-Yan process including contributions from both photon and Z-boson exchange. Our main result is the computation of the QCD corrections to the inclusive production cross section of an axial-vector boson to third order in the strong coupling in a variant of QCD with five massless quark flavours. Since the axial anomaly does not cancel for an odd number of flavours, we also consistently include non-decoupling effects in the top-quark mass through three loops. We perform a phenomenological study of our results, and we present for the first time predictions for the inclusive Drell-Yan process at the LHC at this order in QCD perturbation theory.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Multimessenger signals of heavy axionlike particles in core-collapse supernovae: Two-dimensional simulations

Core-collapse supernovae are a useful laboratory to probe the nature of exotic particles. If axionlike particles (ALPs) are produced in supernovae, they can affect the transfer of energy and leave traces in observational signatures. In this work, we present results from two-dimensional supernova models including the effects of the production and the absorption of ALPs that couple with photons. It is found that the additional heating induced by ALPs can enhance the diagnostic energy of explosion, E diag . For example, for moderate ALP-photon coupling, we find explosion energies ~0.6×10 51 erg compared to our reference model without ALPs of ~0.4×10 51 erg in the first ~0.5 s postbounce explored in this work. Further, our findings indicate that when the coupling constant is sufficiently high, the neutrino luminosities and mean energies are decreased because of the additional cooling of the proto-neutron star via ALPs. The gravitational wave amplitude is also reduced because the mass accretion on the proto-neutron star is suppressed. Although the ALP-photon coupling can foster explodability, including enhancing the explosion energy closer to recent observations, more long-term simulations in three spatial dimensions are needed to draw robust conclusions.

79 ASTRONOMY AND ASTROPHYSICS↗

Search for an axion-like particle in radiative $J/ψ$ decays

We search for an axion-like particle (ALP) a through the process $\psi$(3686) → π + π – J/$\psi$, J/$\psi$ → γa, a → γγ in a data sample of (2.71 ± 0.01) x 10 9 $\psi$(3686) events collected by the BESIII detector. No significant ALP signal is observed over the expected background, and the upper limits on the branching fraction of the decay J/$\psi$ → γa and the ALP-photon coupling constant g aγγ are set at 95% confidence level in the mass range of 0.165 ≤ m a ≤ 2.84 GeV/c 2 . The limits on $\mathscr{B}$(J/$\psi$ → γa) range from 8.3 x 10 –8 to 1.8 x 10 –6 over the search region, and the constraints on the ALP-photon coupling are the most stringent to date for 0.165 ≤ m a ≤ 1.468 GeV/c 2 .

79 ASTRONOMY AND ASTROPHYSICS↗

Giant resonances in topological spin Hall effect due to electron-skyrmion scattering in two-dimensional Rashba spin-orbit ferromagnets

Here we study a topological spin Hall effect where conduction electrons are scattered by Néel-type skyrmions in two-dimensional Rashba spin-orbit ferromagnets. We find the resonance structures in direct and Hall electric conductivities. The resonances strongly depend on the skyrmion size, the Rashba spin-orbit coupling vector value, and the relative direction between magnetization and Rashba vectors. The antiparallel arrangement of the Rashba spin-orbit coupling vector with respect to the magnetization determines the resonance structure and increases the direct conductivity by about two orders of magnitude. For the parallel arrangement the electric conductivities decrease by one to three orders of magnitude and the Hall conductivity changes the sign. The Rashba spin-orbit coupling also modifies electron bands depending on the ratio ε R /J, where ε R is Rashba energy and J is an exchange integral between conduction and localized electrons. If ε R /J ≤ 1, each energy band has the single minimum while for ε R /J > 1 the lower band has the “Mexican-hat” shape with the maximum at k = 0. We focus on the dependencies of direct and Hall electric conductivities on Fermi energy, ε F , skyrmion sizes, and Rashba spin-orbit coupling constant values and its relative direction with the magnetization. Analyzing both types of the energy bands, in general, we find two types of resonances: at the minimum of the upper band and behaviors, we employ the scattering pattern analysis. The resonance dependencies on skyrmion sizes and Rashba, a spin-orbit coupling contestant, can be qualitatively explained in terms of the Ramsauer-Townsend scattering of the upper band electrons by the skyrmion quantum well. The resonance properties can be used in spin transistors. To discover the resonances it is necessary to know the specific range of the parameters. At some values of the parameters the electric conductivity changes by about two orders of magnitude in the narrow range of ε F (< 0.01 eV). To detect the resonances it is also important to identify the relative direction of the Rashba spin-orbit coupling vector with respect to the magnetization.

36 MATERIALS SCIENCE↗

Testing effective field theory with the most general neutron decay correlations

Built on the seminal works by Jackson-Treiman-Wyld and Ebel-Feldman, we derive the most general free neutron differential decay rate where all massive particles (neutron, proton, and electron) are polarized. This introduces 33 new correlations in addition to the 18 existing ones, which overconstrain the coupling constants in the low-energy effective field theory of charged weak interactions, and thus provides stringent tests of the validity of the theory framework itself. We classify the correlation coefficients in terms of their Standard Model limit and discrete symmetries, and study their expansion with respect to the new physics coupling strengths, supplemented by the experiment-independent 𝒪⁡(𝛼) virtual electromagnetic radiative corrections.

Astronomy & Astrophysics↗

Helicity evolution at small x: the single-logarithmic contribution

We calculate single-logarithmic corrections to the small-x flavor-singlet helicity evolution equations derived recently [1–3] in the double-logarithmic approximation. The new single-logarithmic part of the evolution kernel sums up powers of α s ln(1/x), which are an important correction to the dominant powers of α s ln 2 (1/x) summed up by the double-logarithmic kernel from [1–3] at small values of Bjorken x and with α s the strong coupling constant. The single-logarithmic terms arise separately from either the longitudinal or transverse momentum integrals. Consequently, the evolution equations we derive employing the light-cone perturbation theory simultaneously include the small-x evolution kernel and the leading-order polarized DGLAP splitting functions. We further enhance the equations by calculating the running coupling corrections to the kernel.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

NNLL resummation of Sudakov shoulder logarithms in the heavy jet mass distribution

The heavy jet mass event shape has large perturbative logarithms near the leading order kinematic threshold at ρ = $\frac{1}{3}$. Catani and Webber named these logarithms Sudakov shoulders and resummed them at double-logarithmic level. A resummation to next-to-leading logarithmic level was achieved recently. Here, we extend the resummation using an effective field theory framework to next-to-next-to-leading logarithmic order and show how to combine it with the resummation of dijet logarithms. We also solve the open problem of an unphysical singularity in the resummed momentum space distribution, in a way similar to how it is resolved in the Drell-Yan q T spectrum: through a careful analysis of the kinematics and scale-setting in position space. The heavy jet mass Sudakov shoulder is the first observable that does not involve transverse momentum for which position space resummation is critical. These advances may lead to a more precise extraction of the strong coupling constant from e + e – data.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

A Thorough Characterization of the Tellurocyanate Anion

Tellurocyanate, [TeCN] − , is the heaviest group 16 congener of the cyanate anion, [OCN] − . Due to the relative instability of the C─Te bond, tellurocyanate chemistry has seen only scarce attention. Here, we present the facile synthesis and thorough characterization of [K@crypt-222][TeCN]. The anion is essentially linear with interatomic distances C─N = 1.150(6)Å and C─Te = 2.051(4)Å, thus approximating a C≡N triple bond and for C─Te a bond order between 1 and 2. Fully 13 C and 15 N labeled [Te 13 C 15 N] − allowed for the extraction of chemical shifts and all possible coupling constants ( 13 C = 77.8 ppm, 15 N = 285.7 ppm, 125 Te = −566 ppm, 1 J 13C-15N = 8 Hz, 1 J 13C-125Te = 748 Hz, 2 J1 5N-125Te = 55 Hz), which were also determined independently by quantum chemical calculations. In the series [ChCN] − (Ch = O─Te), [TeCN] − shows the strongest spin-orbit coupling (SOC) induced heavy-atom effect on the light-atom shielding (SO-HALA-effect). In contrast, 15 N shifts are also well described without considering relativistic effects and/or SOC. Negative-ion photoelectron spectroscopy was used to extract the electron affinity (EA = 3.034 eV) and spin-orbit splitting (3807 cm −1 ) of [TeCN] • . These values continue the trends of falling EA and rising SOC in the series [ChCN] • .

Bonding analysis↗

Magnetic exchange interactions in binuclear and tetranuclear iron(III) complexes described by spin‐flip DFT and Heisenberg effective Hamiltonians

Abstract Low‐energy spectra of single‐molecule magnets (SMMs) are often described by Heisenberg Hamiltonians. Within this formalism, exchange interactions between magnetic centers determine the ground‐state multiplicity and energy separation between the ground and excited states. In this contribution, we extract exchange coupling constants ( J ) for a set of iron (III) binuclear and tetranuclear complexes from all‐electron calculations using non‐collinear spin‐flip time‐dependent density functional theory (NC‐SF‐TDDFT). For 12 binuclear complexes with J ‐values ranging from −6 to −132 cm −1 , our benchmark calculations using the short‐range hybrid ω PBEh functional and 6‐31G(d,p) basis set agree well with the experimentally derived values (mean absolute error of 4.7 cm −1 ). For the tetranuclear SMMs, the computed J constants are within 6 cm −1 from the experimentally derived values. We explore the range of applicability of the Heisenberg model by analyzing bonding patterns in these Fe(III) complexes using natural orbitals (NO), their occupations, and the number of effectively unpaired electrons. The results illustrate the efficiency of the spin‐flip protocol for computing the exchange couplings and the utility of the NO analysis in assessing the validity of effective spin Hamiltonians.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Quantum Bipolaron Superconductivity from Quadratic Electron-Phonon Coupling

When the electron-phonon coupling is quadratic in the phonon coordinates, electrons can pair to form bipolarons due to phonon zero-point fluctuations, a purely quantum effect. Here we study superconductivity originating from this pairing mechanism in a minimal model and reveal that, in the strong coupling regime, the critical temperature (T c ) is only mildly suppressed by the coupling strength, in stark contrast to the exponential suppression in linearly coupled systems, thus implying higher optimal T c values. We demonstrate that large coupling constants of this flavor are achieved in known materials such as perovskites, and discuss strategies to realize such superconductivity using superlattices.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Impact of the continuum on the γ decay of the lowest 2 + states in 14 C

The half-life, T 1/2 =14.6(33) fs, of the 7012-keV 2$^{+}_{1}$ state in 14 C was measured in an experiment employing the 9 Be( 6 Li,pγ) fusion-evaporation reaction and the GODDESS setup. The γ decay from the 2$^{+}_{2}$ near-threshold resonance, located 142 keV above the 8176-keV neutron-emission threshold, was also investigated. An upper limit of 4.0 × 10 –5 was established for the γ-decay branching ratio with respect to the neutron-decay channel. The B(E2) transition probabilities for these 2$^{+}_{1}$ and 2$^{+}_{2}$ states were compared to predictions from the Shell Model Embedded in the Continuum (SMEC). Significant modifications of these B(E2) probabilities, with respect to the standard shell model, are expected due to the coupling to the continuum. For calculations using the YSOX interaction, agreement was found for large negative values of V 0 , the coupling constant to the continuum. The central value V 0 = −645 MeV fm 3 results in a retardation by a factor ∼ 3.5 for the 2$^{+}_{1}$ → 0$^{+}_{1}$ transition, and an enhanced probability by a factor ∼ 2.5 for the γ-decay out of the 2$^{+}_{2}$ state. The latter factor reflects the effect of collectivization of the 2$^{+}_{2}$ excitation when the coupling to the continuum is taken into account.

14C↗

Light(ly)-coupled dark matter in the keV range: freeze-in and constraints

Dark matter produced from thermal freeze-out is typically restricted to have masses above roughly 1 MeV. However, if the couplings are small, the freeze-in mechanism allows for production of dark matter down to keV masses. We consider dark matter coupled to a dark photon that mixes with the photon and dark matter coupled to photons through an electric or magnetic dipole moment. We discuss contributions to the freeze-in production of such dark matter particles from standard model fermion-antifermion annihilation and plasmon decay. We also derive constraints on such dark matter from the cooling of red giant stars and horizontal branch stars, carefully evaluating the thermal processes as well as the bremsstrahlung process that dominates for masses above the plasma frequency. We find that the parameters needed to obtain the observed relic abundance from freeze-in are excluded below a few tens of keV, depending on the value of the dark gauge coupling constant for the dark photon portal model, and below a few keV, depending on the reheating temperature for dark matter with an electric or magnetic dipole moment. While laboratory probes are unlikely to probe these freeze-in scenarios in general, we show that for dark matter with an electric or magnetic dipole moment and for dark matter masses above the reheating temperature, the couplings needed for freeze-in to produce the observed relic abundance can be probed partially by upcoming direct-detection experiments.

79 ASTRONOMY AND ASTROPHYSICS↗

Zero-field spin resonance in graphene with proximity-induced spin-orbit coupling

In this work we investigate collective spin excitations in graphene with proximity-induced spin-orbit coupling (SOC) of the Rashba and valley-Zeeman types, as it is the case, e.g., for graphene on transition-metal-dichalcogenide substrates. It is shown that, even in the absence of an external magnetic field, such a system supports collective spin modes, which correspond to coupled oscillations of the uniform and valley-staggered magnetizations. These modes can be detected via both zero-field electron spin resonance (ESR) and zero-field electric-dipole spin resonance (EDSR), with EDSR response arising solely due to Rashba SOC. We analyze the effect of electron-electron interaction within the Fermi-liquid kinetic equation and show that the interaction splits both the ESR and EDSR peaks into two. The magnitude of splitting and the relative weights of the resonances can be used to extract the spin-orbit coupling constants and many-body interaction parameters that may not be accessible by other methods.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Structure and Magnetic Properties of Pseudo-1D Chromium Thiolate Coordination Polymers

The synthesis, structure, and magnetic properties of two novel, pseudo-one-dimensional (1D) chromium thiolate coordination polymers (CPs), CrBTT and Cr2BDT3, are reported. The structures of these materials were determined using X-ray powder diffraction revealing highly symmetric 1D chains embedded within a CP framework. The magnetic coupling of this chain system was measured by SQUID magnetometry, revealing a switch from antiferromagnetic to ferromagnetic behavior dictated by the angular geometrical constraints within the CP scaffold consistent with the Goodenough–Kanamori–Anderson rules. Intrachain magnetic coupling constants J NN of –32.0 and +5.7 K were found for CrBTT and Cr 2 BDT 3 , respectively, using the 1D Bonner–Fisher model of magnetism. The band structure of these materials has also been examined by optical spectroscopy and density functional theory calculations revealing semiconducting behavior. Furthermore, our findings here demonstrate how CP scaffolds can support idealized low-dimensional structural motifs and dictate magnetic interactions through tuning of geometry and inter-spin couplings.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Development of (NO)Fe(N 2 S 2 ) as a Metallodithiolate Spin Probe Ligand: A Case Study Approach

The ubiquity of sulfur–metal connections in nature inspires the design of bi- and multimetallic systems in synthetic inorganic chemistry. Common motifs for biocatalysts developed in evolutionary biology include the placement of metals in close proximity with flexible sulfur bridges as well as the presence of π-acidic/delocalizing ligands. This Account will delve into the development of a (NO)Fe(N 2 S 2 ) metallodithiolate ligand that harnesses these principles. The Fe(NO) unit is the centroid of a N 2 S 2 donor field, which as a whole is capable of serving as a redox-active, bidentate S-donor ligand. Its paramagnetism as well as the ν(NO) vibrational monitor can be exploited in the development of new classes of heterobimetallic complexes. We offer four examples in which the unpaired electron on the {Fe(NO)} 7 unit is spin-paired with adjacent paramagnets in proximal and distal positions. First, the exceptional stability of the (NO)Fe(N 2 S 2 )-Fe(NO) 2 platform, which permits its isolation and structural characterization at three distinct redox levels, is linked to the charge delocalization occurring on both the Fe(NO) and the Fe(NO) 2 supports. This accommodates the formation of a rare nonheme {Fe(NO)} 8 triplet state, with a linear configuration. A subsequent FeNi complex, featuring redox-active ligands on both metals (NO on iron and dithiolene on nickel), displayed unexpected physical properties. Our research showed good reversibility in two redox processes, allowing isolation in reduced and oxidized forms. Various spectroscopic and crystallographic analyses confirmed these states, and Mössbauer data supported the redox change at the iron site upon reduction. Oxidation of the complex produced a dimeric dication, revealing an intriguing magnetic behavior. The monomer appears as a spin-coupled diradical between {Fe(NO)} 7 and the nickel dithiolene monoradical, while dimerization couples the latter radical units via a Ni 2 S 2 rhomb. Magnetic data (SQUID) on the dimer dication found a singlet ground state with a thermally accessible triplet state that is responsible for magnetism. A theoretical model built on an H 4 chain explains this unexpected ferromagnetic low-energy triplet state arising from the antiferromagnetic coupling of a four-radical molecular conglomerate. For comparison, two (NO)Fe(N 2 S 2 ) were connected through diamagnetic group 10 cations producing diradical trimetallic complexes. Antiferromagnetic coupling is observed between {Fe(NO)} 7 units, with exchange coupling constants (J) of -3, -23, and -124 cm –1 for Ni II , Pd II , and Pt II , respectively. This trend is explained by the enhanced covalency and polarizability of sulfur-dense metallodithiolate ligands. A central paramagnetic trans-Cr(NO)(MeCN) receiver unit core results in a cissoid structural topology, influenced by the stereoactivity of the lone pair(s) on the sulfur donors. This {Cr(NO)} 5 radical bridge, unlike all previous cases, finds the coupling between the distal Fe(NO) radicals to be ferromagnetic (J = 24 cm –1 ). The stability and predictability of this S = 1/2 moiety and the steric/electronic properties of the bridging thiolate sulfurs suggest it to be a likely candidate for the development of novel molecular (magnetic) compounds and possibly materials. The role of synthetic inorganic chemistry in designing synthons that permit connections of the (NO)Fe(N 2 S 2 ) metalloligand is highlighted as well as the properties of the heterobi- and polymetallic complexes derived therefrom.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Nematic superconductivity in twisted bilayer graphene

Twisted bilayer graphene displays insulating and superconducting phases caused by exceptional flattening of its lowest energy bands. Superconductivity with highest T c appears near half filling of the valence band (n ≈ –2). The data show that in the large part of the superconducting dome near n = –2, threefold lattice rotation symmetry is broken in the superconducting phase, i.e., a superconductor is also a nematic. We perform a comprehensive analysis of superconductivity in twisted-bilayer graphene within an itinerant approach and present a mechanism for nematic superconductivity. We take as an input the fact that at dopings, where superconductivity has been observed, the Fermi energy lies in the vicinity of twist-induced Van Hove singularities in the density of states. We argue that the low-energy physics can be properly described by patch models with either six or twelve Van Hove points. We obtain pairing interactions for the patch models in terms of parameters of the microscopic model for the flat bands, which contains both local and twist-induced nonlocal interactions. Here, we show that the latter give rise to attraction in different superconducting channels. For six Van Hove points, there is just one attractive d-wave channel, and we find chiral d ± id superconducting order, which breaks time-reversal symmetry but leaves the lattice rotation symmetry intact. For twelve Van Hove points, we find two attractive channels, g and i waves, with almost equal coupling constants. We show that both order parameters are nonzero in the ground state and explicitly demonstrate that in this co-existence state the threefold lattice rotation symmetry is broken, i.e., the superconducting state is also a nematic. We find two possible nematic states, one is time-reversal symmetric, the other additionally breaks time-reversal symmetry. We apply our scenario to twisted bilayer graphene near n = –2 and argue that it is applicable also to other systems with two (or more) attractive channels with similar couplings as our reasoning for a nematic superconductivity is based on generic symmetry considerations.

36 MATERIALS SCIENCE↗

High-resolution infrared spectroscopy of supersonically cooled singlet carbenes: Bromomethylene (HCBr) in the CH stretch region

First high-resolution spectra of cold (~35 K) singlet bromomethylene HCBr in the CH stretching (v 1 ) region from 2770 to 2850 cm-1 are reported using near quantum shot-noise limited laser absorption methods in a slit jet supersonic discharge expansion source. Three rovibrational bands are identified at high S/N (20:1 - 40:1) and rotationally assigned to i) the CH stretch fundamental (v 1 ) band $\tilde{X}$(1,0,0) ← $\tilde{X}$ (0,0,0) and ii) vibrational hot bands ($\tilde{X}$(1,1,0) ← $\tilde{X}$(0,1,0) and $\tilde{X}$(1,0,1) ← $\tilde{X}$(0,0,1)) arising from vibrationally excited HCBr populated in the discharge with single quanta in either the H–C–Br bend (v 2 ) or C–Br stretch (v 3 ) modes. Precision rotational constants are reported for a total of six states, with an experimentally determined CH stretch vibrational frequency (2799.38 cm -1 ) in good agreement with previous low-resolution fluorescence studies. Detailed analysis of the fundamental v 1 band highlights the presence of perturbations in the $\tilde{X}$(1,0,0) level, which we tentatively attribute to arise from the nearby triplet state $\tilde{a}$(0,0,1) through spin-orbit interaction or the multiple quanta $\tilde{X}$(0,2,1) singlet state via c-type Coriolis coupling. Reduced-Doppler resolution (60 MHz) in the slit-jet IR spectrometer permits clear observation of nuclear spin hyperfine structure, with experimental line shapes well reproduced by nuclear quadrupole/spin-rotation coupling constants from microwave studies. Lastly, the a-type to b-type transition intensity ratio for the fundamental CH stretch band is notably larger than predicted by a bond-dipole model, which from high level ab initio quantum calculations (CCSD(T)/PVQZ) can be attributed to vibrationally induced “charge-sloshing” of electron density along the polar C–Br bond.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗