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At least 703 records · Page 39

Exploring metastable states in UO 2 using hybrid functionals and dynamical mean field theory

A detailed exploration of the f-atomic orbital occupancy space for UO2 is performed using a first principles approach based on density functional theory (DFT), employing a full hybrid functional within a systematic basis set. Specifically, the PBE0 functional is combined with an occupancy biasing scheme implemented in a wavelet-based algorithm which is adapted to large supercells. The results are compared with previous DFT + U calculations reported in the literature, while dynamical mean field theory is also performed to provide a further base for comparison. This work shows that the computational complexity of the energy landscape of a correlated f-electron oxide is much richer than has previously been demonstrated. The resulting calculations provide evidence of the existence of multiple previously unexplored metastable electronic states of UO 2 , including those with energies which are lower than previously reported ground states.

36 MATERIALS SCIENCE↗

Exploring electron beam induced atomic assembly via reinforcement learning in a molecular dynamics environment

We report atom-by-atom assembly of functional materials and devices is perceived as one of the ultimate targets of nanotechnology. Recently it has been shown that the beam of a scanning transmission electron microscope can be used for targeted manipulation of individual atoms. However, the process is highly dynamic in nature rendering control difficult. One possible solution is to instead train artificial agents to perform the atomic manipulation in an automated manner without need for human intervention. As a first step to realizing this goal, we explore how artificial agents can be trained for atomic manipulation in a simplified molecular dynamics environment of graphene with Si dopants, using reinforcement learning. We find that it is possible to engineer the reward function of the agent in such a way as to encourage formation of local clusters of dopants under different constraints. This study shows the potential for reinforcement learning in nanoscale fabrication, and crucially, that the dynamics learned by agents encode specific elements of important physics that can be learned.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

Exploring drift effects in TCV single-null plasmas with the UEDGE code

This study explores the effects of particle drifts across the magnetic field in TCV single-null plasmas using the two-dimensional edge plasma transport code UEDGE. In particular, it aims to reproduce a double-peaked density target profile, a feature which has been observed both at JET and in a TCV forward-field (${\rm{\nabla }}B$ drift of core ions towards the X-point) discharge. Initial simulations are performed with drift effects turned off. This allows identification of the input parameters that strongly influence the computed steady-state but are not well known from the experiment. Including cross-field drifts self-consistently in the simulations brings computed profiles at the inner target closer to the experiment, with the double peak being reproduced for the density. In agreement with the experiment, simulations of a similar reversed-field shot yield lower n e and higher T e at the inner target, as well as unchanged temperatures at the outer plate. However, several discrepancies remain. In the forward field case, the inner target density peak near the separatrix is much sharper than seen experimentally. Furthermore, simulations show a strong dependence of the outer plate density and of the outer/inner power sharing on toroidal field direction. Experimentally, no such dependencies are observed. In the simulations, the changes of target profiles with field direction are mainly due to E × B drifts in the divertor region. Finally, while these simulations highlight the importance of E × B drifts in these TCV plasmas, the remaining differences with the experiment indicate that their role is overestimated in the simulations.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Exploring extreme magnetization phenomena in directly driven imploding cylindrical targets

Abstract This paper uses extended-magnetohydrodynamics (MHD) simulations to explore an extreme magnetized plasma regime realizable by cylindrical implosions on the OMEGA laser facility. This regime is characterized by highly compressed magnetic fields (greater than 10 kT across the fuel), which contain a significant proportion of the implosion energy and induce large electrical currents in the plasma. Parameters governing the different magnetization processes such as Ohmic dissipation and suppression of instabilities by magnetic tension are presented, allowing for optimization of experiments to study specific phenomena. For instance, a dopant added to the target gas-fill can enhance magnetic flux compression while enabling spectroscopic diagnosis of the imploding core. In particular, the use of Ar K-shell spectroscopy is investigated by performing detailed non-LTE atomic kinetics and radiative transfer calculations on the MHD data. Direct measurement of the core electron density and temperature would be possible, allowing for both the impact of magnetization on the final temperature and thermal pressure to be obtained. By assuming the magnetic field is frozen into the plasma motion, which is shown to be a good approximation for highly magnetized implosions, spectroscopic diagnosis could be used to estimate which magnetization processes are ruling the implosion dynamics; for example, a relation is given for inferring whether thermally driven or current-driven transport is dominating.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Exploring two-field inflation in the Wess-Zumino model

We explore inflation via the effective potential of the minimal Wess-Zumino model, considering both the real and imaginary components of the complex field. Using transport techniques, we calculate the full allowed range of n{sub s}, r and f{sub NL} for different choices of the single free parameter, v, and present the probability distribution of these signatures given a simple choice for the prior distribution of initial conditions. Our work provides a case study of multi-field inflation in a simple but realistic setting, with important lessons that are likely to apply more generally. For example, we find that there are initial conditions consistent with observations of n{sub s} and r for values of v that would be excluded if only evolutions in the real field direction were to be considered, and that these may yield enhanced values of f{sub NL}. Moreover, we find that initial conditions fixed at high energy density, where the potential is close to quartic in form, can still lead to evolutions in a concave region of the potential during the observable number of e-folds, as preferred by present data. The Wess-Zumino model therefore provides an illustration that multi-field dynamics must be taken into account when seeking to understand fully the phenomenology of such models of inflation.

79 ASTRONOMY AND ASTROPHYSICS↗

Phenomenology of dark energy: exploring the space of theories with future redshift surveys

We use the effective field theory of dark energy to explore the space of modified gravity models which are capable of driving the present cosmic acceleration. We identify five universal functions of cosmic time that are enough to describe a wide range of theories containing a single scalar degree of freedom in addition to the metric. The first function (the effective equation of state) uniquely controls the expansion history of the universe. The remaining four functions appear in the linear cosmological perturbation equations, but only three of them regulate the growth history of large scale structures. We propose a specific parameterization of such functions in terms of characteristic coefficients that serve as coordinates in the space of modified gravity theories and can be effectively constrained by the next generation of cosmological experiments. We address in full generality the problem of the soundness of the theory against ghost-like and gradient instabilities and show how the space of non-pathological models shrinks when a more negative equation of state parameter is considered. This analysis allows us to locate a large class of stable theories that violate the null energy condition (i.e. super-acceleration models) and to recover, as particular subsets, various models considered so far. Finally, under the assumption that the true underlying cosmological model is the Λ Cold Dark Matter (ΛCDM) scenario, and relying on the figure of merit of EUCLID-like observations, we demonstrate that the theoretical requirement of stability significantly narrows the empirical likelihood, increasing the discriminatory power of data. We also find that the vast majority of these non-pathological theories generating the same expansion history as the ΛCDM model predict a different, lower, growth rate of cosmic structures.

79 ASTRONOMY AND ASTROPHYSICS↗

Exploring 0.1–10 eV axions with a new helioscope concept

We explore the possibility to develop a new axion helioscope type, sensitive to the higher axion mass region favored by axion models. We propose to use a low background large volume TPC immersed in an intense magnetic field. Contrary to traditional tracking helioscopes, this detection technique takes advantage of the capability to directly detect the photons converted on the buffer gas which defines the axion mass sensitivity region, and does not require pointing the magnet to the Sun. The operation flexibility of a TPC to be used with different gas mixtures (He, Ne, Xe, etc.) and pressures (from 10 mbar to 10 bar) will allow to enhance sensitivity for axion masses from few meV to several eV. We present different helioscope data taking scenarios, considering detection efficiency and axion absorption probability, and show the sensitivities reachable with this technique to be few × 10{sup −11} GeV{sup −1} for a 5 T, m{sup 3} scale TPC. We show that a few years program taking data with such setup would allow to probe the KSVZ axion model for axion masses above 0∼> 10 meV.

79 ASTRONOMY AND ASTROPHYSICS↗

Exploring JLA supernova data with improved flux-averaging technique

In this work, we explore the cosmological consequences of the ''Joint Light-curve Analysis'' (JLA) supernova (SN) data by using an improved flux-averaging (FA) technique, in which only the type Ia supernovae (SNe Ia) at high redshift are flux-averaged. Adopting the criterion of figure of Merit (FoM) and considering six dark energy (DE) parameterizations, we search the best FA recipe that gives the tightest DE constraints in the ( z {sub cut}, Δ z ) plane, where z {sub cut} and Δ z are redshift cut-off and redshift interval of FA, respectively. Then, based on the best FA recipe obtained, we discuss the impacts of varying z {sub cut} and varying Δ z , revisit the evolution of SN color luminosity parameter β, and study the effects of adopting different FA recipe on parameter estimation. We find that: (1) The best FA recipe is ( z {sub cut} = 0.6, Δ z =0.06), which is insensitive to a specific DE parameterization. (2) Flux-averaging JLA samples at z {sub cut} ≥ 0.4 will yield tighter DE constraints than the case without using FA. (3) Using FA can significantly reduce the redshift-evolution of β. (4) The best FA recipe favors a larger fractional matter density Ω {sub m} . In summary, we present an alternative method of dealing with JLA data, which can reduce the systematic uncertainties of SNe Ia and give the tighter DE constraints at the same time. Our method will be useful in the use of SNe Ia data for precision cosmology.

79 ASTRONOMY AND ASTROPHYSICS↗

The DESI One-Percent survey: exploring the Halo Occupation Distribution of Emission Line Galaxies with AbacusSummit simulations

The One-Percent survey of the Dark Energy Spectroscopic Instrument collected ~ 270k emission line galaxies (ELGs) at 0.8 < z < 1.6. The high completeness of the sample allowed the clustering to be measured down to scales never probed before, 0.04 Mpc/h in rp for the projected 2-point correlation function (2PCF) and 0.17 Mpc/h in galaxy pair separation s for the 2PCF monopole and quadrupole. The most striking feature of the measurements is a strong signal at the smallest scales, below 0.2 Mpc/h in rp and 1 Mpc/h in s. We analyse these data in the halo occupation distribution framework. We consider different distributions for central galaxies, a standard power law for satellites with no condition on the presence of a central galaxy and explore several extensions of these models. For all considered models, the mean halo mass of the sample is found to be log10 $\langle$Mh$\rangle$ ~ 11.9. We obtain a satellite mean occupation function which agrees with physically motivated ELG models only if we introduce central-satellite conformity, meaning that the satellite occupation is conditioned by the presence of central galaxies of the same type. To achieve in addition a good modelling of the clustering between 0.1 and 1 Mpc/h in rp, we allow for ELG positioning outside of the halo virial radius and find 0.5% of ELGs residing in the outskirts of halos. Furthermore, the satellite velocity dispersion inside halos is found to be ~ 30% larger than that of the halo dark matter particles. These are the main findings of our work. Here we investigate assembly bias as a function of halo concentration, local density or local density anisotropies and observe no significant change in our results. We split the data sample in two redshift bins and report no significant evolution with redshift. Lastly, changing the cosmology in the modelling impacts only slightly our results.

79 ASTRONOMY AND ASTROPHYSICS↗

Exploring dark forces with multimessenger studies of extreme mass ratio inspirals

Abstract The exploration of dark sector interactions via gravitational waves (GWs) from binary inspirals has been a subject of recent interest. We study dark forces using extreme mass ratio inspirals (EMRIs), pointing out two issues of interest. Firstly, the innermost stable circular orbit (ISCO) of the EMRI, which sets the characteristic length scale of the system and hence the dark force range to which it exhibits enhanced sensitivity, probes force mediator masses that complement those studied with supermassive black hole (SMBH) or neutron star binaries. The LISA mission (the proposedμAres detector) will probe mediators with massesm V ∼ 10 -16 eV (m V ∼ 10 -18 eV), corresponding to ISCOs of 10 6 M ⊙ (10 8 M ⊙ ) central SMBHs. Secondly, while the sensitivity to dark couplings is typically limited by the uncertainty in the binary component masses, independent mass measurements of the central SMBH through reverberation mapping campaigns or the motion of dynamical tracers enable one to break this degeneracy. Our results therefore highlight the necessity for coordinated studies, loosely referred to as “multimessenger”, between futureμHz- mHz GW observatories and ongoing and forthcoming SMBH mass measurement campaigns, including OzDES-RM, SDSS-RM, and SDSS-V Black Hole Mapper.

Astronomy & Astrophysics↗

PFPO plasma scenarios for exploration of long pulse operation in ITER

Long Pulse Scenarios (LPS) in ITER foreseen during the Pre-Fusion Power Operation (PFPO) phase of the ITER Research Plan (IRP) are assessed using 1.5D transport simulations within the ASTRA framework. Such assessment is required to predict the operational space for LPS operation in PFPO, as well as to evaluate which physics processes for LPS operation during Fusion Power Operation (FPO) could be studied during PFPO. An important aspect in the development of LPSs in PFPO is to minimize lifetime consumption of the Central Solenoid (CS) for these scenarios. The maximum pulse length achievable for LPSs in PFPO with no consumption of CS lifetime (currents in CS coils $&LessSlantEqual;$30 kA per turn) has been assessed for a range of heating schemes and heating mixes, confinement regimes (L-mode and H-mode) and for helium and hydrogen plasmas. The operational space of LPS and pulse length has been explored through density scans with the Heating and Current Drive mix required for the FPO Q $&GreaterSlantEqual;$ 5 steady-state plasma scenario (namely Neutral Beam Injection and Electron Cyclotron Heating) including acceptable shine through losses on the first wall for both helium and hydrogen plasmas. Fast particle physics aspects that are common between FPO plasmas and LPS PFPO H-mode plasmas at low densities are studied including MHD stability analysis with the KINX code and non-perturbative critical gradient model based on high-n Toroidal Alfven Eigenmodes (TAE) stability kinetic ballooning code HINST calculations.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Exploring the fusion power plant design space: comparative analysis of positive and negative triangularity tokamaks through optimization

The optimal configuration choice between positive triangularity (PT) and negative triangularity (NT) tokamaks for fusion power plants hinges on navigating different operational constraints rather than achieving specific plasma performance metrics. This study presents a systematic comparison using constrained multi-objective optimization with the integrated FUsion Synthesis Engine (FUSE) framework. Over 200 000 integrated design evaluations were performed exploring the trade-offs between capital cost minimization and operational reliability (maximizing q 95 ) while satisfying engineering constraints including 250 ± 50 MW net electric power, tritium breeding ratio > 1.1, power exhaust limits and an hour flattop time. Both configurations achieve similar cost-performance Pareto fronts through contrasting design philosophies. PT, while demonstrating resilience to pedestal degradation (compensating for up to 40% reduction), are constrained to larger machines (R 0 > 6.5 m) by the narrow operational window between L–H threshold requirements and the research-established power exhaust limit (P sol /R < 15 MW m –1 ). This forces optimization through comparatively reduced magnetic field (∼8 T). NT configurations exploit their freedom from these constraints to access compact, high-field designs (R 0 ~ 5.5 m, B 0 >12 T), creating natural synergy with advancing HTS technology. Sensitivity analyses reveal that PT’s economic viability depends critically on uncertainties in L–H threshold scaling and power handling limits. Notably, a 50% variation in either could eliminate viable designs or enable access to the compact design space. These results suggest configuration selection should be risk-informed: PT offers the lowest-cost path when operational constraints can be confidently predicted, while NT is robust to large variations in constraints and physics uncertainties.

FUSE framework↗

An efficient approach to explore the solution space of a wind turbine rotor design process

This study proposes a novel approach to explore the solution space of a wind turbine rotor design process. The goal is to offer to blade designers the possibility to select an optimal rotor for given market conditions, assessing trade-offs and alternatives in a matter of minutes. The design process consists of sequential aerodynamic-structural optimizations, where the two loops are linked via a blade-loading parameter that can be varied by the user. A design study is performed starting from the IEA Wind Task 37 land-based reference wind turbine. The solution space is characterized for rotor diameters in the range of 130–160 m, rated generator power values in the range of 3.0–6.0 MW, and tip-speed ratios in the range of 7.5–12.5. Results are discussed highlighting optimal design decisions and trade-offs.

17 WIND ENERGY↗

Exploring Replica-Exchange Wang-Landau sampling in higher-dimensional parameter space

We considered a higher-dimensional extension for the replica-exchange Wang-Landau algorithm to perform a random walk in the energy and magnetization space of the two-dimensional Ising model. This hybrid scheme combines the advantages of Wang-Landau and Replica-Exchange algorithms, and the one-dimensional version of this approach has been shown to be very efficient and to scale well, up to several thousands of computing cores. This approach allows us to split the parameter space of the system to be simulated into several pieces and still perform a random walk over the entire parameter range, ensuring the ergodicity of the simulation. Previous work, in which a similar scheme of parallel simulation was implemented without using replica exchange and with a different way to combine the result from the pieces, led to discontinuities in the final density of states over the entire range of parameters. From our simulations, it appears that the replica-exchange Wang-Landau algorithm is able to overcome this diculty, allowing exploration of higher parameter phase space by keeping track of the joint density of states.

Valentim, Alexandra↗

Exploring cesium properties internal to the LANSCE H - ion source using resonant absorption spectroscopy

The Los Alamos Neutron Science Center (LANSCE) H - ion source has provided stable output for decades of LANL mission needs, but its maximum beam output has remained the same at ~15 mA. A roadblock to improving beam output has been a lack of thorough understanding of the internal mechanisms of LANSCE H - ion source. The LANSCE H - Ion Source Laser Diagnostic Stand (HLDS) was recently built and commissioned to explore these internal mechanisms using laser absorption techniques, to measure and diagnose dynamic H - and cesium densities. The cesium density probe is based on resonant absorption of a continuous wave diode laser tuned though the D 2 line of cesium (~852 nm). The diagnostic capabilities of HLDS will be reviewed, and measurements using the cesium laser diagnostic will be presented.

43 PARTICLE ACCELERATORS↗

FUNDAMENTAL ASPECTS OF EPISODIC ACCRETION CHEMISTRY EXPLORED WITH SINGLE-POINT MODELS

We explore a set of single-point chemical models to study the fundamental chemical aspects of episodic accretion in low-mass embedded protostars. Our goal is twofold: (1) to understand how the repeated heating and cooling of the envelope affects the abundances of CO and related species; and (2) to identify chemical tracers that can be used as a novel probe of the timescales and other physical aspects of episodic accretion. We develop a set of single-point models that serve as a general prescription for how the chemical composition of a protostellar envelope is altered by episodic accretion. The main effect of each accretion burst is to drive CO ice off the grains in part of the envelope. The duration of the subsequent quiescent stage (before the next burst hits) is similar to or shorter than the freeze-out timescale of CO, allowing the chemical effects of a burst to linger long after the burst has ended. We predict that the resulting excess of gas-phase CO can be observed with single-dish or interferometer facilities as evidence of an accretion burst in the past 10{sup 3}-10{sup 4} yr.

79 ASTRONOMY AND ASTROPHYSICS↗

RAPID INFRARED VARIABILITY OF THREE RADIO-LOUD NARROW-LINE SEYFERT 1 GALAXIES: A VIEW FROM THE WIDE-FIELD INFRARED SURVEY EXPLORER

Using newly released data from the Wide-field Infrared Survey Explorer, we report the discovery of rapid infrared variability in three radio-loud narrow-line Seyfert 1 galaxies (NLS1s) selected from the 23 sources in the sample of Yuan et al. J0849+5108 and J0948+0022 clearly show intraday variability, while J1505+0326 has a longer measurable timescale within 180 days. Their variability amplitudes, corrected for measurement errors, are {approx}0.1-0.2 mag. The detection of intraday variability restricts the size of the infrared-emitting region to {approx}10{sup -3} pc, significantly smaller than the scale of the torus but consistent with the base of a jet. The three variable sources are exceptionally radio-loud, have the highest radio brightness temperature among the whole sample, and all show detected {gamma}-ray emission in Fermi/LAT observations. Their spectral energy distributions resemble those of low-energy-peaked blazars, with a synchrotron peak around infrared wavelengths. This result strongly confirms the view that at least some radio-loud NLS1s are blazars with a relativistic jet close to our line of sight. The beamed synchrotron emission from the jet contributes significantly to and probably dominates the spectra in the infrared and even optical bands.

79 ASTRONOMY AND ASTROPHYSICS↗

PREDICTING Lyα AND Mg II FLUXES FROM K AND M DWARFS USING GALAXY EVOLUTION EXPLORER ULTRAVIOLET PHOTOMETRY

A star's ultraviolet (UV) emission can greatly affect the atmospheric chemistry and physical properties of closely orbiting planets with the potential for severe mass loss. In particular, the Lyα emission line at 1216 Å, which dominates the far-ultraviolet (FUV) spectrum, is a major source of photodissociation of important atmospheric molecules such as water and methane. The intrinsic flux of Lyα, however, cannot be directly measured due to the absorption of neutral hydrogen in the interstellar medium and contamination by geocoronal emission. To date, reconstruction of the intrinsic Lyα line based on Hubble Space Telescope spectra has been accomplished for 46 FGKM nearby stars, 28 of which have also been observed by the Galaxy Evolution Explorer (GALEX). Our investigation provides a correlation between published intrinsic Lyα and GALEX far- and near-ultraviolet (NUV) chromospheric fluxes for K and M stars. The negative correlations between the ratio of the Lyα to the GALEX fluxes reveal how the relative strength of Lyα compared to the broadband fluxes weakens as the FUV and NUV excess flux increase. We also correlate GALEX fluxes with the strong NUV Mg II h+k spectral emission lines formed at lower chromospheric temperatures than Lyα. The reported correlations provide estimates of intrinsic Lyα and Mg II fluxes for the thousands of K and M stars in the archived GALEX all-sky surveys. These will constrain new stellar upper atmosphere models for cool stars and provide realistic inputs to models describing exoplanetary photochemistry and atmospheric evolution in the absence of UV spectroscopy.

79 ASTRONOMY AND ASTROPHYSICS↗