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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 577 records · Page 32

Inelastic Scattering of a Photon by a Quantum Phase Slip

Spontaneous decay of a single photon is a notoriously inefficient process in nature irrespective of the frequency range. We report that a quantum phase-slip fluctuation in high-impedance superconducting waveguides can split a single incident microwave photon into a large number of lower-energy photons with a near unit probability. The underlying inelastic photon-photon interaction has no analogs in non-linear optics. Instead, the measured decay rates are explained without adjustable parameters in the framework of a new model of a quantum impurity in a Luttinger liquid. Our result connects circuit quantum electrodynamics to critical phenomena in two-dimensional boundary quantum field theories, important in the physics of strongly-correlated systems. Here, the photon lifetime data represents a rare example of verified and useful quantum many-body simulation.

1-dimensional systems↗

Gas Flow in the Capillary of the Atmosphere-to-Vacuum Interface of Mass Spectrometers

Numerical simulations of a gas flow through a capillary being a part of mass spectrometer atmospheric interface were performed using a detailed laminar flow model. The simulated interface consisted of atmospheric and forevacuum volumes connected via a thin capillary. The pressure in the forevacuum volume where the gas was expanding after passing through the capillary was varied in the wide range from 10 to 900 mbar in order to study the volume flow rate as well as the other flow parameters as functions of the pressure drop between the atmospheric and forevacuum volumes. The capillary wall temperature was varied in the range from 24 to 150 °C. Numerical integration of the complete system of Navier-Stokes equations for a viscous compressible gas taking into account the heat transfer was performed using the standard gas dynamic simulation software package ANSYS CFX. The simulation results were compared with experimental measurements of gas flow parameters both performed using our experimental setup and taken from the literature. The simulated volume flow rates through the capillary differed no more than by 10% from the measured ones over the entire pressure and temperatures ranges. A conclusion was drawn that the detailed digital laminar model is able to quantitatively describe the measured gas flow rates through the capillaries under conditions considered. .

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Phase transitions in the antiferromagnetic Ising model on a body-centered cubic lattice with interactions between next-to-nearest neighbors

Phase transitions in the antiferromagnetic Ising model on a body-centered cubic lattice are studied on the basis of the replica algorithm by the Monte Carlo method and histogram analysis taking into account the interaction of next-to-nearest neighbors. The phase diagram of the dependence of the critical temperature on the intensity of interaction of the next-to-nearest neighbors is constructed. It is found that a second-order phase transition is realized in this model in the investigated interval of the intensities of interaction of next-to-nearest neighbors.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Route to supersolidity for the extended Bose-Hubbard model

We use the Gutzwiller ansatz and analyze the phase diagram of the extended Bose-Hubbard Hamiltonian with on-site (U) and nearest-neighbor (V) repulsions. For d-dimensional hypercubic lattices, when 2dV<U, it is well known that the ground state alternates between the charge-density-wave (CDW) and Mott insulators, and the supersolid (SS) phase occupies small regions around the CDW insulators. However, when 2dV>U, in this Rapid Communication, we show that the ground state has only CDW insulators, and more importantly, the SS phase occupies a much larger region in the phase diagram, existing up to very large hopping values which could be orders of magnitude higher than that of the well-known case. In particular, the SS-superfluid phase boundary increases linearly as a function of hopping when 2dV > or approx. 1.5U, for which the prospects of observing the SS phase with dipolar Bose gases loaded into optical lattices is much higher.

74 ATOMIC AND MOLECULAR PHYSICS↗

Half-ice, half-fire-driven ultranarrow phase crossover in one-dimensional decorated 𝑞-state Potts ferrimagnets: An AI-co-led exploration

OpenAI’s reasoning model o3-mini-high was used to carry out an exact analytic study of one-dimensional ferrimagnetic site- and bond-decorated 𝑞-state Potts models. We demonstrate that the finite-temperature ultranarrow phase crossover (UNPC), driven by a hidden “half-ice, half-fire” state recently discovered in the 𝑞=2 case (Ising model), persists for 𝑞>2. Moreover, we identify unique features for 𝑞>2, including the dome structure in the field-temperature phase diagram, and for large 𝑞 a secondary high-temperature UNPC to the fully disordered paramagnetic state. As the UNPC quickly approaches a genuine transition by enhancing 𝐽, the interaction between the backbone spins, two distinct behaviors emerge: In the site-decorated Potts model, 𝑇 0 is independent of 𝐽 and thus remains unchanged (Type-I UNPC), and in the bond-decorated Potts model with 𝑞>2, 𝑇 0 depends on 𝐽 and quickly shifts toward a finite temperature as 𝐽 increases (Type-II UNPC). These results establish a versatile framework for engineering controlled fast state-flipping switches in low-dimensional systems. Our nine-dan artificial intelligence (AI)-contribution framework assigns AI the meritorious status of AI-co-led discovery in this work.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Cluster Method of Constructing Bethe Approximation for the Ising Model of a Dilute Magnet

The paper offers an interpretation of Bethe approximation based on comparison of spin clusters of different sizes on the Cayley tree. Based on this interpretation, the authors suggested the method to construct Bethe approximation for the node- or bond-diluted Ising magnet. The method provides an accurate value of the percolation threshold for the Bethe lattice. For different variations of this method, the authors constructed spontaneous magnetizations at zero and final temperatures as a function of concentration of magnetic atoms and found an analytical expression for the critical indicator of the correlation length.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Phase Diagram at Finite Chemical Potentials in the Nambu-Jona-Lasinio Model

We study the phase diagram of two flavor dense QCD at finite isospin and baryon chemical potentials in the framework of Nambu-Jona-Lasinio model. The system undergoes a crossover from a Bose-Einstein condensate of charged pions to a BCS superfluid with condensed quark-antiquark Cooper pairs when {mu}{sub I} increases at {mu}{sub B} = 0, and a nonzero baryon chemical potential serves as a mismatch between the pairing species. We observe a gapless pion condensation phase near the quadruple point ({mu}{sub I},{mu}{sub B}) = (m{sub {pi}},M{sub N}-1.5m{sub {pi}}) where m{sub {pi}}, M{sub N} are the vacuum masses of pions and nucleons, respectively. At very large isospin chemical potential, {mu}{sub I}>6.36m{sub {pi}}, an inhomogeneous LOFF superfluid phase appears in a window of {mu}{sub B}. Between the gapless and the LOFF phases, the pion superfluid phase and the normal quark matter phase are connected by a first order phase transition.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Understanding grain boundary segregation under irradiation: A mesoscale modeling study

Grain boundaries (GBs) are an important component in the design of irradiation resistant materials as they play a crucial role as point defect sinks for non-equilibrium vacancies and self-interstitials. However, in the presence of sustained point defect fluxes, the coupled transport of atomic components with inherently different diffusivities often leads to radiation-induced segregation (RIS), with undesired effects on properties such as intergranular corrosion and stress-assisted cracking. In this talk, we investigate the fundamental mechanisms leading to GB segregation in BCC FeCr-based alloys using multiscale modeling and experiments. A phase-field model is employed to account for both thermodynamic and kinetic segregation mechanisms. The full Onsager transport matrix is derived using kinetic Monte Carlo, molecular dynamics, and kinetic cluster expansion (KineCluE) calculations. The thermodynamics of GB segregation is described via an atomic density-based modification to the CALPHAD free energy. The modeling predictions are then compared against segregation data from atom probe characterization for various temperatures, compositions, and neutron irradiation conditions. We will conclude by discussing the utility of the multiscale modeling approach to shed light on the fundamental mechanisms leading to solute-GB interaction.

36 MATERIALS SCIENCE↗

Critical Properties of the Anisotropic Ising Model with Competitive Interactions in the Region of a Phase Transition from the Modulated Phase to the Paramagnetic One

Monte Carlo methods are used to study the anisotropic Ising model with competing interactions in the region of the phase transition from the modulated to the paramagnetic phase. Using histogram analysis of Monte Carlo data and the theory of finite-size scaling, it is shown that the transition from the modulated state to the paramagnetic one is a second-order phase transition. The critical parameters and temperatures of phase transitions in this region are calculated. It is shown that the modulated–paramagnetic phase transition cannot be described within the framework of the known universality classes of critical behavior.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Plasma analogy and non-Abelian statistics for Ising-type quantum Hall states

We study the non-Abelian statistics of quasiparticles in the Ising-type quantum Hall states which are likely candidates to explain the observed Hall conductivity plateaus in the second Landau level, most notably the one at filling fraction {nu}=5/2. We complete the program started in V. Gurarie and C. Nayak, [Nucl. Phys. B 506, 685 (1997)]. and show that the degenerate four-quasihole and six-quasihole wave functions of the Moore-Read Pfaffian state are orthogonal with equal constant norms in the basis given by conformal blocks in a c=1+(1/2) conformal field theory. As a consequence, this proves that the non-Abelian statistics of the excitations in this state are given by the explicit analytic continuation of these wave functions. Our proof is based on a plasma analogy derived from the Coulomb gas construction of Ising model correlation functions involving both order and (at most two) disorder operators. We show how this computation also determines the non-Abelian statistics of collections of more than six quasiholes and give an explicit expression for the corresponding conformal block-derived wave functions for an arbitrary number of quasiholes. Our method also applies to the anti-Pfaffian wave function and to Bonderson-Slingerland hierarchy states constructed over the Moore-Read and anti-Pfaffian states.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Attractive Su-Schrieffer-Heeger-Hubbard model on a square lattice away from half-filling

The Su-Schrieffer-Heeger (SSH) model, with bond phonons modulating electron tunneling, is a paradigmatic electron-phonon model that hosts an antiferromagnetic order to bond order transition at half-filling. In the presence of a repulsive Hubbard interaction, the antiferromagnetic phase is enhanced, but the phase transition remains first order. Here, we explore the physics of the SSH model with an attractive Hubbard interaction, which hosts an interesting interplay among charge order, s-wave pairing, and bond order. Using the numerically exact determinant quantum Monte Carlo method, we show that both charge order, present at weak electron-phonon coupling, and bond order, at large coupling, give way to s-wave pairing when the system is doped. Lastly, we demonstrate that the SSH electron-phonon interaction competes with the attractive Hubbard interaction and reduces the s-wave pairing correlation.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Pair Density Wave Order from Electron Repulsion

A pair density wave (PDW) is a superconductor whose order parameter is a periodic function of space, without an accompanying spatially uniform component. Since PDWs are not the outcome of a weak-coupling instability of a Fermi liquid, a generic pairing mechanism for PDW order has remained elusive. Here, we describe and solve models having robust PDW phases. To access the intermediate coupling limit, we invoke large-$N$ limits of Fermi liquids with repulsive BCS interactions that admit saddle point solutions. We show that the requirements for long-range PDW order are that the repulsive BCS couplings must be nonmonotonic in space and that their strength must exceed a threshold value. We obtain a phase diagram with both finite temperature transitions to PDW order and a $T = 0$ quantum critical point, where non-Fermi liquid behavior occurs.

2-dimensional systems↗

Solvable 3D Kondo Lattice Exhibiting Pair Density Wave, Odd-Frequency Pairing, and Order Fractionalization

The Kondo lattice model plays a key role in our understanding of quantum materials, but a lack of small parameters has posed a long-standing problem. We present a 3 dimensional S= 1 2 Kondo lattice model describing a spin liquid within an electron sea. Strong correlations in the spin liquid are treated exactly, enabling a controlled analytical approach. Like a Peierls or BCS phase, a logarithmically divergent susceptibility leads to an instability into a new phase at arbitrarily small Kondo coupling. Our solution captures a plethora of emergent phenomena, including odd-frequency pairing, pair density wave formation and order fractionalization. The ground-state state is a pair density wave with a fractionalized charge e, S = 1/2 order parameter, formed between electrons and Majorana fermions.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Pulse-noise approach for classical spin systems

For systems of classical spins interacting with the bath via damping and thermal noise, a technique is suggested to replace the white noise by a pulse noise acting at regular time intervals Δ t , within which the system evolves conservatively. The method is working well in the typical case of a small dimensionless damping constant λ and allows a considerable speedup of computations by using high-order numerical integrators with a large time step δ t (up to a fraction of the precession period), while keeping δ t &NestedLessLess; Δ t to reduce the relative contribution of noise-related operations. In cases when precession can be discarded, δ t can be increased up to a fraction of the relaxation time ∝ 1 / λ that leads to a further speedup. This makes equilibration speed comparable with that of the Metropolis Monte Carlo method. The pulse-noise approach is tested on single-spin and multispin models.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Modelling morphology evolution during solidification of IPP in processing conditions

During polymer processing, crystallization takes place during or soon after flow. In most of cases, the flow field dramatically influences both the crystallization kinetics and the crystal morphology. On their turn, crystallinity and morphology affect product properties. Consequently, in the last decade, researchers tried to identify the main parameters determining crystallinity and morphology evolution during solidification In processing conditions. In this work, we present an approach to model flow-induced crystallization with the aim of predicting the morphology after processing. The approach is based on: interpretation of the FIC as the effect of molecular stretch on the thermodynamic crystallization temperature; modeling the molecular stretch evolution by means of a model simple and easy to be implemented in polymer processing simulation codes; identification of the effect of flow on nucleation density and spherulites growth rate by means of simple experiments; determination of the condition under which fibers form instead of spherulites. Model predictions reproduce most of the features of final morphology observed in the samples after solidification.

36 MATERIALS SCIENCE↗

Lattice architecture effect on the cooperativity of spin transition coordination polymers

We have investigated in the framework of the Ising-like model, by means of Monte Carlo Metropolis method with open boundary condition, the architecture effect on the cooperativity of spin transition coordination polymers. We have analyzed the influence of several physical parameters (size, pressure, and edge effects) on different lattice architectures which were in good agreement with reported experimental data. We show that the cooperativity of a spin crossover system, characterized by the same number of molecules and the same short- and long-range interaction parameters, is progressively enhanced when going from a 1D chain to a 1D ladder type lattice and to a 2D square lattice.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Tuning the hydrophobicity of mica surfaces by hyperthermal Ar ion irradiation

The hydrophobicity of surfaces has a strong influence on their interactions with biomolecules such as proteins. Therefore, for in vitro studies of bio-surface interactions model surfaces with tailored hydrophobicity are of utmost importance. Here, we present a method for tuning the hydrophobicity of atomically flat mica surfaces by hyperthermal Ar ion irradiation. Due to the sub-100 eV energies, only negligible roughening of the surface is observed at low ion fluences and also the chemical composition of the mica crystal remains almost undisturbed. However, the ion irradiation induces the preferential removal of the outermost layer of K{sup +} ions from the surface, leading to the exposure of the underlying aluminosilicate sheets which feature a large number of centers for C adsorption. The irradiated surface thus exhibits an enhanced chemical reactivity toward hydrocarbons, resulting in the adsorption of a thin hydrocarbon film from the environment. Aging these surfaces under ambient conditions leads to a continuous increase of their contact angle until a fully hydrophobic surface with a contact angle >80 deg. is obtained after a period of about 3 months. This method thus enables the fabrication of ultrasmooth biological model surfaces with precisely tailored hydrophobicity.

36 MATERIALS SCIENCE↗

Two-particle photoemission from strongly correlated systems: A dynamical mean-field approach

We study theoretically the simultaneous photoinduced two-particle excitations of strongly correlated systems on the basis of the Hubbard model. Under certain conditions specified in this work, the corresponding transition probability is related to the two-particle spectral function which we calculate using three different methods: the dynamical mean-field theory combined with quantum Monte Carlo technique, the first-order perturbation theory and the ladder approximations. The results are analyzed and compared for systems at the verge of the metal-insulator transitions. The dependencies on the electronic correlation strength and on doping are explored. In addition, the account for the orbital degeneracy allows an insight into the influence of interband correlations on the two-particle excitations. A suitable experimental realization is discussed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗