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At least 1,549 records · Page 86

Nonperturbative Zou-Wang-Mandel effect

The Zou-Wang-Mandel (ZWM) effect is a remarkable consequence of photon indistinguishability and continuous-variable entanglement in which an optical phase shift is imprinted on photonic modes associated with optical paths that that do not pass through the phase shift source. By bringing the canonical formalism of continuous-variable Gaussian states to bear on the mode-structure of the ZWM experiment, we show that the physical consequence of implementing optical path identity is a renormalization of quadrature squeezing which governs the entanglement of four effective optical modes. Nonperturbative expressions for the ZWM interference patterns and normalized first-order coherence function are derived. Generalizations to $\mathscr{H}$-graph states with more than four modes directly follow from the general method used to analyze the minimal example. Here, we show that a ZWM interferometer with a laser-seeded signal mode, which estimates an idler phase shift by detecting photons that did not propagate through the phase shift, exhibits an optimal sensitivity comparable to that of a laser-seeded SU(1,1) interferometer if path identity is implemented with high fidelity.

74 ATOMIC AND MOLECULAR PHYSICS↗

Thermodynamics of Light Management in Near-Field Thermophotovoltaics

We evaluate near-field thermophotovoltaic (TPV) energy-conversion systems focusing in particular on their open-circuit voltage (V OC ). Unlike previous analyses based largely on numerical simulations with fluctuational electrodynamics, here, we develop an analytic model that captures the physics of near-field TPV systems and can predict their performance metrics. Using our model, we identify two opportunities of TPV systems operating in the near field. First, we show analytically that enhancement of radiative recombination is a natural consequence of operating in the near field. Second, we note that, owing to photon recycling and minimal radiation leakage in near-field operation, the PV cell used in near-field TPV systems can be much thinner compared to those used in solar PV systems. Since nonradiative recombination is a volumetric effect, use of a thinner cell reduces nonradiative losses per unit area. The combination of these two opportunities leads to increasingly large values of V OC as the TPV vacuum gap decreases. Hence, although operation in the near-field was previously perceived to be beneficial for electrical power-density enhancement, here, we emphasize that thin-film near-field TPVs are also significantly advantageous in terms of V OC and consequently conversion efficiency as well as power density. We provide numerical results for an InAs-based thin-film TPV that exhibits efficiency >50% at an emitter temperature as low as 1100 K.

42 ENGINEERING↗

Theory of collective magnetophonon resonance and melting of a field-induced Wigner solid

Electron solid phases of matter are revealed by characteristic vibrational resonances. Sufficiently large magnetic fields can overcome the effects of disorder, leading to a weakly pinned collective mode called the magnetophonon. Consequently, in this regime it is possible to develop a tightly constrained hydrodynamic theory of pinned magnetophonons. Here, the behavior of the magnetophonon resonance across thermal and quantum melting transitions has been experimentally characterized in two-dimensional electron systems. Applying our theory to these transitions we explain several key features of the data. Firstly, violation of the Fukuyama-Lee sum rule as the transition is approached is shown to be a consequence of the non-Lorentzian form taken by the resonance. Secondly, this non-Lorentzian shape is shown to be caused by dissipative channels that become especially important close to melting: proliferating dislocations and uncondensed charge carriers.

36 MATERIALS SCIENCE↗

Influence of hydrogenation on the vibrational density of states of magnetocaloric LaFe 11.4 Si 1.6 H 1.6

We report on the impact of magnetoelastic coupling on the magnetocaloric properties of LaFe 11.4 Si 1.6 H 1.6 in terms of the vibrational (phonon) density of states (VDOS), which we determined with 57 Fe nuclear resonant inelastic x-ray scattering (NRIXS) measurements and with density functional theory (DFT) based first-principles calculations in the ferromagnetic (FM) low-temperature and paramagnetic (PM) high-temperature phase. In experiments and calculations, we observe pronounced differences in the shape of the Fe-partial VDOS between nonhydrogenated and hydrogenated samples. Furthermore, this shows that hydrogen not only shifts the temperature of the first-order phase transition, but also affects the elastic response of the Fe subsystem significantly. In turn, the anomalous redshift of the Fe VDOS, observed by going to the low-volume PM phase, survives hydrogenation. As a consequence, the change in the Fe-specific vibrational entropy ΔS lat across the phase transition has the same sign as the magnetic and electronic contribution. DFT calculations show that the same mechanism, which is a consequence of the itinerant electron metamagnetism associated with the Fe subsystem, is effective in both the hydrogenated and the hydrogen-free compounds. Although reduced by 50% as compared to the hydrogen-free system, the measured change ΔS lat of 3.2 ± 1.9)J/ kg K across the FM-to-PM transition contributes with ~35 % significantly and cooperatively to the total isothermal entropy change ΔS iso . Hydrogenation is observed to induce an overall blueshift of the Fe VDOS with respect to the H-free compound; this effect, together with the enhanced Debye temperature observed, is a fingerprint of the hardening of the Fe sublattice by hydrogen incorporation. In addition, the mean Debye velocity of sound of LaFe 11.4 Si 1.6 H 1.6 was determined from the NRIXS and the DFT data.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Path integral approach to quantum anomalies in interacting models

The prediction and subsequent discovery of topological semimetal phases of matter in solid state systems has instigated a surge of activity investigating the exotic properties of these unusual materials. Among these are transport signatures which can be attributed to the chiral anomaly; the breaking of classical chiral symmetry in a quantum theory. This remarkable quantum phenomenon, first discovered in the context of particle physics has now found new life in condensed-matter physics, connecting topological quantum matter and band theory with effective field theoretic models. In this paper we investigate the interplay between interactions and the chiral anomaly in field theories inspired by semimetals using Fujikawa's path integral method. Starting from models in one spatial dimension we discuss how the presence of interactions can affect the consequences of the chiral anomaly leading to renormalization of excitations and their transport properties. This is then generalized to the three-dimensional case where we show that the anomalous response of the system, namely, the chiral magnetic and quantum Hall effects, are modified by the presence of interactions. These properties are investigated further through the identification of anomalous modes which exist within interacting Weyl semimetals. These massive excitations are nonperturbative in nature and are a direct consequence of the chiral anomaly. The effects of interactions on mixed axial-gravitational anomalies are then investigated and the conditions required for interaction effects to be observed are discussed.

Anomalies↗

Symmetry of reentrant tetragonal phase in Ba 1 - x Na x Fe 2 As 2 : Magnetic versus orbital ordering mechanism

Magnetostructural phase transitions in Ba 1-x A x Fe 2 As 2 (A = K, Na) materials are discussed for both magnetically and orbitally driven mechanisms, using a symmetry analysis formulated within the Landau theory of phase transitions. Both mechanisms predict identical orthorhombic space-group symmetries for the nematic and magnetic phases observed over much of the phase diagram, but they predict different tetragonal space-group symmetries for the newly discovered reentrant tetragonal phase in Ba 1-x Na x Fe 2 As 2 (x similar to 0.24-0.28). In a magnetic scenario, magnetic order with moments along the c axis, as found experimentally, does not allow any type of orbital order, but in an orbital scenario, we have determined two possible orbital patterns, specified by P4/mnc1' and I4221' space groups, which do not require atomic displacements relative to the parent I4/mmm1' symmetry and, in consequence, are indistinguishable in conventional diffraction experiments. We demonstrate that the three possible space groups are, however, distinct in resonant x-ray Bragg diffraction patterns created by Templeton & Templeton scattering. This provides an experimental method of distinguishing between magnetic and orbital models.

Khalyavin, D. D.↗

Charge partitioning and anomalous hole doping in Rh-doped Sr 2 IrO 4

The simultaneous presence of sizable spin-orbit interactions and electron correlations in iridium oxides has led to predictions of novel ground states including Dirac semimetals, Kitaev spin liquids, and superconductivity. Electron and hole doping studies of spin-orbit assisted Mott insulator Sr 2 IrO 4 are being intensively pursued due to extensive parallels with the La 2 CuO 4 parent compound of cuprate superconductors. In particular, the mechanism of charge doping associated with replacement of Ir with Rh ions remains controversial with profound consequences for the interpretation of electronic structure and transport data. Using x-ray absorption near edge structure measurements at the Rh L, K, and Ir L edges we observe anomalous evolution of charge partitioning between Rh and Ir with Rh doping. The partitioning of charge between Rh and Ir sites progresses in a way that holes are initially doped into the J eff = 1/2 band at low x only to be removed from it at higher x values. Furthermore, this anomalous hole doping naturally explains the reentrant insulating phase in the phase diagram of Sr 2 Ir 1–x Rh x O 4 and ought to be considered when searching for superconductivity and other emergent phenomena in iridates doped with 4d elements.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Emergent orbitals in the cluster Mott insulator on a breathing kagome lattice

Motivated by the recent developments on cluster Mott insulating materials such as the cluster magnet LiZn 2 Mo 3 O 8 , we consider the strong plaquette charge ordered regime of the extended Hubbard model on a breathing kagome lattice and reveal the properties of the cluster Mottness. The plaquette charge order arises from the intersite charge interaction and the collective motion of three localized electrons on the hexagon plaquettes. This model leads naturally to a reduction of the local moments by 2/3, as observed in LiZn 2 Mo 3 O 8 . Furthermore, at low temperatures, each hexagon plaquette contains an extra orbital-like degree of freedom in addition to the remaining spin 1/2. We explore the consequence of this emergent orbital degree of freedom. We point out the interaction between the local moments is naturally described by a Kugel-Khomskii spin-orbital model. We develop a parton approach and suggest a spin-liquid ground state with spinon Fermi surfaces for this model. Here, we further predict an emergent orbital order when the system is under a strong magnetic field. Various experimental consequences for LiZn 2 Mo 3 O 8 are discussed, including an argument that the charge ordering must be short ranged if the charge per Mo is slightly off stoichiometric.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Phase transition and electronic structure evolution of MoTe 2 induced by W substitution

We report that the transition-metal dichalcogenide compounds MoTe 2 and WTe 2 are polymorphic with both semiconducting and metallic phases. The thermodynamically stable phase of WTe 2 at room temperature is orthorhombic and metallic and displays a wide range of interesting phenomena including type-II Weyl fermions, titanic magnetoresistance and superconductivity in bulk, and quantum spin Hall insulator behavior in the monolayer case. On the other hand, the stable phase of MoTe 2 at room temperature is a trigonal prismatic semiconductor that has a direct gap in the monolayer with strong spin-orbit coupling. The alloy series Mo 1-x W x Te 2 thus offers the possibility for tuning the structural and, consequently, electronic phases via tuning of the composition. Here, we report comprehensive studies of the electronic structure of Mo 1-x W x Te 2 alloys using angle-resolved photoemission spectroscopy and first-principles calculations as a function of composition. At room temperature, we find a sharp boundary between the orthorhombic and the trigonal prismatic phases at x = 0.10 using structural characterization. Finally, we also show that by compositional tuning it is possible to control the band inversion in this series of compounds thus yielding important consequences for topological surface states.

36 MATERIALS SCIENCE↗

Signatures of rare states and thermalization in a theory with confinement

There is a dichotomy in the nonequilibrium dynamics of quantum many-body systems. In the presence of integrability, expectation values of local operators equilibrate to values described by a generalized Gibbs ensemble, which retains extensive memory about the initial state of the system. On the other hand, in generic systems such expectation values relax to stationary values described by the thermal ensemble, fixed solely by the energy of the state. At the heart of understanding, this dichotomy is the eigenstate thermalization hypothesis (ETH): individual eigenstates in nonintegrable systems are thermal, in the sense that expectation values agree with the thermal prediction at a temperature set by the energy of the eigenstate. In systems where ETH is violated, thermalization can be avoided. Thus, establishing the range of validity of ETH is crucial in understanding whether a given quantum system thermalizes. Here, we study a simple model with confinement, the quantum Ising chain with a longitudinal field, in which ETH is violated. Despite an absence of integrability, there exist rare (nonthermal) states that persist far into the spectrum. These arise as a direct consequence of confinement: pairs of particles are confined, forming new “meson” excitations whose energy can be extensive in the system size. We show that such states are nonthermal in both the continuum and in the low-energy spectrum of the corresponding lattice model. Here, we highlight that the presence of such states within the spectrum has important consequences, with certain quenches leading to an absence of thermalization and local observables evolving anomalously.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

High-precision mass measurements of the isomeric and ground states of 44 V: Improving constraints on the isobaric multiplet mass equation parameters of the A=44, 0 + quintet

Background: The quadratic isobaric multiplet mass equation (IMME) has been very successful at predicting the masses of isobaric analog states in the same multiplet, while its coefficients are known to follow specific trends as functions of mass number. The Atomic Mass Evaluation 2016 [Chin. Phys. C 41, 030003 (2017)] 44 V mass value results in an anomalous negative c coefficient for the IMME quadratic term; a consequence of large uncertainty and an unresolved isomeric state. The b and c coefficients can provide useful constraints for construction of the isospin-nonconserving Hamiltonians for the pf shell. In addition, the excitation energy of the 0 + , T = 2 level in 44 V is currently unknown. This state can be used to constrain the mass of the more exotic 44 Cr. Purpose: The aim of the experimental campaign was to perform high-precision mass measurements to resolve the difference between 44 V isomeric and ground states, to test the IMME using the new ground state mass value and to provide necessary ingredients for the future identification of the 0 + , T = 2 state in 44 V. Method: High-precision Penning trap mass spectrometry was performed at LEBIT, located at the National Superconducting Cyclotron Laboratory, to measure the cyclotron frequency ratios of [ 44g,m VO] + versus [ 32 SCO] + , a well-known reference mass, to extract both the isomeric and ground state masses of 44 V. Results: The mass excess of the ground and isomeric states in 44 V were measured to be -23 804.9(80) keV/c 2 and -23 537.0(55) keV/c 2 , respectively. This yielded a new proton separation energy of S p = 1 773(10) keV. Conclusion: The new values of the ground state and isomeric state masses of 44 V have been used to deduce the IMME b and c coefficients of the lowest 2 + and 6 + triplets in A = 44. The 2 + c coefficient is now verified with the IMME trend for lowest multiplets and is in good agreement with the shell-model predictions using charge-dependent Hamiltonians. The mirror energy differences were determined between 44 V and 44 Sc, in line with isospin-symmetry for this multiplet. Finally, the new value of the proton separation energy determined, to an uncertainty of 10 keV, will be important for the determination of the 0 + , T = 2 state in 44 V and, consequently, for prediction of the mass excess of 44 Cr.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Nuclear-level effective theory of 𝜇→𝑒 conversion: Formalism and applications

Over the next decade new 𝜇→𝑒 conversion searches at Fermilab (Mu2e) and J-PARC (COMET, DeeMe) are expected to advance limits on charged lepton flavor violation (CLFV) by more than four orders of magnitude. Here, by considering the consequence of 𝑃 and 𝐶⁢𝑃 on elastic 𝜇→𝑒 conversion and the structure of possible charge and current densities, we show that rates are governed by six nuclear responses and a single scale, 𝑞/𝑚 𝑁 , where 𝑞 ≈ 𝑚 𝜇 is the momentum transferred from the leptons to the nucleus. To relate this result to microscopic formulations of CLFV, we construct in nonrelativistic effective theory (NRET) the CLFV nucleon-level interaction, pointing out the relevance of the dimensionless scales 𝑦=($^{𝑞⁢𝑏}_2$) 2 ⁢ > |$\overrightarrow{𝑣}_N$⁢|>|$\overrightarrow{𝑣}_μ$⁢|>|$\overrightarrow{𝑣}_T$| , where 𝑏 is the nuclear size, $\overrightarrow{𝑣}_N$ and $\overrightarrow{𝑣}_μ$ are the nucleon and muon intrinsic velocities, and $\overrightarrow{𝑣}_T$ is the target recoil velocity. We discuss previous work, noting the lack of a systematic treatment of the various small parameters. Because the parameter 𝑦 is not small, a proper calculation of 𝜇→𝑒 conversion requires a full multipole expansion of the nuclear response functions, an apparently daunting task with Coulomb-distorted electron partial waves. We demonstrate that the multipole expansion can be carried out to high precision by introducing a simplifying local momentum 𝑞 eff for the electron. Previous work has been limited to simple charge or spin interactions, thereby treating the nucleus effectively as a point particle. We show that such formulations are not compatible with the general form of the 𝜇→𝑒 conversion rate, failing to generate three of the six allowed nuclear response functions. The inclusion of the nucleon velocity $\overrightarrow{𝑣}_N$ yields an NRET with 16 operators and a rate of the general form. Consequently, in the current discovery era for CLFV, it provides the most sensible starting point for experimental analysis, defining what can and cannot be determined about CLFV from the highly exclusive process of 𝜇→𝑒 conversion. Finally, we expand the NRET operator basis to account for the effects of $\overrightarrow{𝑣}_μ$, associated with the muon's lower component, generating corrections to the CLFV coefficients of the point-nucleus response functions. Using advanced shell-model methods, we compute 𝜇→𝑒 conversion rates for a series of experimental targets, deriving bounds on the coefficients of the CLFV operators. These calculations are the first to include a general basis of CLFV operators, full evaluation of the associated nuclear response functions, and an accurate treatment of electron and muon Coulomb effects. We discuss target selection as an experimental “knob” that can be turned to probe the microscopic origins of CLFV. We describe two types of coherence that enhance certain CLFV operators and selection rules that blind elastic 𝜇→𝑒 conversion to others. We discuss the matching of the NRET onto higher level effective field theories, such as those constructed at the light quark level, noting opportunities to build on existing work in direct detection of dark matter. We discuss the relation of 𝜇→𝑒 conversion to 𝜇→𝑒+𝛾 and 𝜇→3⁢𝑒, showing how MEG II and Mu3e results will complement those of Mu2e and COMET. Finally we describe a accompanying script—in Mathematica and Python versions—that can be used to compute 𝜇→𝑒 conversion rates in various nuclear targets for the full set of NRET operators.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Observable predictions for massive-neutrino cosmologies with model-independent dark energy

We investigate the bounds on the sum of neutrino masses in a cosmic-acceleration scenario where the equation of state w(z) of dark energy (DE) is constructed in a model-independent way, using a basis of principal components (PCs) that are allowed to cross the phantom barrier w(z) = –1. We find that the additional freedom provided to w(z) means the DE can undo changes in the background expansion induced by massive neutrinos at low redshifts. This has two significant consequences: (1) it leads to a substantial increase in the upper bound for the sum of the neutrino masses (M ν < 0.33–0.55 eV at the 95% C.L. depending on the data sets and number of PCs included) compared to studies that choose a specific parametrization for w(z); and (2) it causes ~1σ deviations from ΛCDM in the luminosity distance and the Hubble expansion rate at higher redshifts (z ≳ 2), where the contribution of DE is subdominant and there is little constraining data. The second point consequently means that there are also observable deviations in the shear power spectrum and in the matter power spectrum at low redshift, since the clustering of matter throughout cosmic time depends on the expansion rate. This provides a compelling case to pursue high-z BAO and SN measurements as a way of disentangling the effects of neutrinos and dark energy. Lastly, we find that the additional freedom given to the dark energy component has the effect of lowering S 8 with respect to ΛCDM.

79 ASTRONOMY AND ASTROPHYSICS↗

Final state radiation from high and ultrahigh energy neutrino interactions

Charged leptons produced by high-energy and ultrahigh-energy neutrinos have a substantial probability of emitting prompt internal bremsstrahlung ν ℓ + N → ℓ + X + γ . This can have important consequences for neutrino detection. We discuss observable consequences at high- and ultrahigh-energy neutrino telescopes and the Large Hadron Collider’s (LHC’s) Forward Physics Facility. Logarithmic enhancements can be substantial (e.g., ∼ 20 % ) when either the charged lepton’s energy or the rest of the cascade is measured. We comment on final state radiation’s impacts on measuring the inelasticity distribution, ν / ν ¯ flux ratio, throughgoing muons, and double-bang signatures for high-energy neutrino observation. Furthermore, for ultrahigh-energy neutrino observation, we find that final state radiation increases the overall detectable energy by as much as 20%, affects flavor measurements, and decreases the energy of both Earth-emergent tau leptons and regenerated tau neutrinos. Many of these have significant impacts on measuring neutrino fluxes and spectra. Finally, for the LHC’s Forward Physics Facility, we find that final state radiation will impact future extractions of strange quark parton distribution functions. Final state radiation should be included in future analyses at neutrino telescopes and the Forward Physics Facility. Published by the American Physical Society 2025

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Using the standard solar model to constrain solar composition and nuclear reaction 𝑆 factors

While standard solar model (SSM) predictions depend on approximately 20 input parameters, SSM neutrino flux predictions are strongly correlated with a single model output parameter, the core temperature 𝑇 𝑐 . Consequently, one can extract physics from solar neutrino flux measurements while minimizing the consequences of SSM uncertainties, by studying flux ratios with appropriate power-law weightings tuned to cancel this 𝑇 𝑐 dependence. Here, we reexamine an idea for constraining the primordial C + N content of the solar core from a ratio of CN-cycle 15 O to pp-chain 8 B neutrino fluxes, showing that non-nuclear SSM uncertainties in the ratio are small and effectively governed by a single parameter, the diffusion coefficient. We point out that measurements of both CN-I cycle neutrino branches— 15 O and 13 N 𝛽-decay—could, in principle, lead to separate determinations of the core C and N abundances, due to out-of-equilibrium CN-cycle burning in the cooler outer layers of the solar core. Lastly, we show that the strategy of constructing “minimum uncertainty” neutrino flux ratios can also test other properties of the SSM. In particular, we demonstrate that a weighted ratio of 7 Be and 8 B fluxes constrains a product of S-factors to the same precision currently possible with laboratory data.

Serenelli, Aldo↗

Non-Abelian dark matter and dark radiation

We propose a new class of dark matter models with unusual phenomenology. What is ordinary about our models is that dark matter particles are WIMPs, they are weakly coupled to the Standard Model and have weak scale masses. What is unusual is that they come in multiplets of a new "dark" non-Abelian gauge group with milliweak coupling. The massless dark gluons of this dark gauge group contribute to the energy density of the universe as a form of weakly self-interacting dark radiation. In this paper we explore the consequences of having i.) dark matter in multiplets ii.) self-interacting dark radiation and iii.) dark matter which is weakly coupled to dark radiation. We find that i.) dark matter cross sections are modified by multiplicity factors which have significant consequences for collider searches and indirect detection, ii.) dark gluons have thermal abundances which affect the CMB as dark radiation. Unlike additional massless neutrino species the dark gluons are interacting and have vanishing viscosity and iii.) the coupling of dark radiation to dark matter represents a new mechanism for damping the large scale structure power spectrum. A combination of additional radiation and slightly damped structure is interesting because it can remove tensions between global ΛCDM fits from the CMB and direct measurements of the Hubble expansion rate (H 0 ) and large scale structure (σ 8 ).

79 ASTRONOMY AND ASTROPHYSICS↗

Material effects on dynamics in triple-nozzle gas-puff Z pinches

Here, the gas-puff Z pinch has a long history with myriad applications as an efficient neutron or x-ray source. Its simplicity as a load configuration makes it suitable for studying fundamental plasma physics phenomena such as instabilities and energy transport. For example, the implosion of cylindrical shells onto a fusion fuel are inherently susceptible to instability growth on their external surfaces; if such instabilities are unmitigated, then the consequences in terms of degraded performance can be substantial. Similarly, mitigating heat transport from a hot fuel to its colder surrounding container can make fusion conditions more easily achievable. Here we have conducted a systematic study of triple-nozzle (outer liner, inner liner, fuel) gas puffs using two-dimensional (2D) magnetohydrodynamic simulations to investigate the effect of load material on the relevant dynamics. Analogous to past studies on spherical blast waves and converging shock waves, a trend emerges linking increased radiative cooling, lower adiabatic index, and increased magneto-Rayleigh-Taylor instability growth. Notably, our results suggest that, for the present configuration, Ar radiates less than both Ne and Kr during the early stages of the implosion while mass is being swept up and perturbations begin to seed instability growth. Consequently, pinches with Ar on the outer surface exhibit more stable 2D behavior. Here we also present a parameter scan of thermonuclear neutron yield, Y, as a function of peak current, I pk and dopant concentration with Ne or Ar, depending on the inner liner material. Above 6 MA, our results suggest Y ∝ $I$$^{5}_{pk}$ and even substantial mixing (10% by volume) of Ne into the fuel does not drastically reduce yield, suggesting an Ar/Ne/fuel configuration may reliably achieve DD thermonuclear yields of 10 13 – 10 14 /cm in the 10–20 MA range.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Translational diffusion of water inside hydrophobic carbon micropores studied by neutron spectroscopy and molecular dynamics simulation

When water molecules are confined to nanoscale spacings, such as in the nanometer-size pores of activated carbon fiber (ACF), their freezing point gets suppressed down to very low temperatures (~150 K), leading to a metastable liquid state with remarkable physical properties. Here we have investigated the ambient pressure diffusive dynamics of water in microporous Kynol ACF-10 (average pore size ~11.6 Å, with primarily slit-like pores) from temperature T = 280 K in its stable liquid state down to T = 230 K into the metastable supercooled phase. The observed characteristic relaxation times and diffusion coefficients are found to be, respectively, higher and lower than those in bulk water, indicating a slowing down of the water mobility with decreasing temperature. The observed temperature-dependent average relaxation time (${{\tau}}$) when compared to previous findings indicate that it is the width of the slit pores-not their curvature-that primarily affects the dynamics of water for pore sizes larger than 10 Å. The experimental observations are compared to complementary molecular dynamics simulations of a model system, in which we studied the diffusion of water within the 11.6 Å gap of two parallel graphene sheets. We find generally a reasonable agreement between the observed and calculated relaxation times at the low momentum transfer Q (Q ≤ 0.9 Å -1) . At high Q, however, where localized dynamics becomes relevant, this ideal system does not satisfactorily reproduce the measurements. Consequently, the simulations are compared to the experiments at low Q, where the two can be best reconciled. The best agreement is obtained for the diffusion parameter D associated with the hydrogen-site when a representative stretched exponential function, rather than the standard bimodal exponential model, is used to parametrize the self-correlation function I (Q,t).

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗