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Three Jahn-Teller States of Matter in Spin-Crossover System Mn(taa)
Three high-spin phases recently discovered in the spin-crossover system Mn(taa) are identified through analysis by a combination of first-principles calculations and Monte Carlo simulation as a low-temperature Jahn-Teller ordered (solid) phase, an intermediate-temperature dynamically correlated (liquid) phase, and an uncorrelated (gas) phase. In particular, the Jahn-Teller liquid phase arises from competition between mixing with low-spin impurities, which drive the disorder, and intermolecular strain interactions. Additionally, the latter are a key factor in both the spin-crossover phase transition and the magnetoelectric coupling. Jahn-Teller liquids may exist in other spin-crossover materials and materials that have multiple equivalent Jahn-Teller axes.
New states of matter and chemistry at extreme pressures: Low-Z extended solid
Abstract
Capturing a new state of matter: relativistic electron-positron plasma (FY2020 Final Report)
This is a final report to LLNL summarizing results of the project funded by a sub-contract AWD015218 to investigate the generation and confinement of pair electron-positron plasma and its application for high-energy-density physics and astrophysics.
Capturing a New State of Matter: Relativistic Electron-Positron Plasma (LDRD Final Report)
Relativistic electron-positron (pair) plasmas were a main component of the universe shortly after the Big Bang and are produced around many astrophysical objects, but laboratory pair plasmas have remained elusive. High-intensity lasers can drive dense relativistic positron jets; over the last ten years, we have optimized high-energy ultra-short-pulse laser-matter interaction experiments to make a large number (10 10 – 10 12 ) of positrons in a small volume (< 3 mm 3 ). However, these jets are transient (10 ps), making observations of collective effects difficult. The goal of 20-LW-021 was to trap laser-driven electron-positron jets using pulsed-power-driven high-magnetic-field solenoids, allowing longer confinement times and ultimately an observable laboratory relativistic pair plasma. The project has been remarkably successful: we have found that pulsed-power magnetic fields can effectively trap laser-driven charged particles and produce charge-neutral pair beams. The project thus far has resulted in six published journal articles. The success of these components has put a laboratory pair plasma almost within reach.
Predictive Theory of Topological States of Matter (Final Report for DOE Award DE-SC0018945)
This DOE award supported the PI’s research on topological quantum materials between 2018 and 2021. The PI developed predictive theories for new classes of topological insulators and topological/unconventional superconductors and identified their material realizations in collaboration with experimentalists. The PI theorized new topological transport phenomena, including spin superfluidity in moire materials and the superconducting diode effect. Topological transport phenomena have potential applications in cryogenic computing, low-power electronics, high-frequency rectification, infrared detection, energy harvesting and thermoelectric application. By discovering new quantum materials and new functional properties, the PI’s research contributed significantly to the advancement of DOE scientific and technological base, especially in energy frontier research.
As a Matter of State: The Role of Thermodynamics in Magnetohydrodynamic Turbulence
Turbulence simulations play a key role in advancing the general understanding of the physical properties of turbulence and in interpreting astrophysical observations of turbulent plasmas. For the sake of simplicity, however, turbulence simulations are often conducted in the isothermal limit. Given that the majority of astrophysical systems are not governed by isothermal dynamics, we aim to quantify the impact of thermodynamics on the physics of turbulence, through varying adiabatic index, γ, combined with a range of optically thin cooling functions. Here, we present a suite of ideal magnetohydrodynamics simulations of thermally balanced stationary turbulence in the subsonic, super-Alfvénic, high ${\beta }_{{\rm{p}}}$ (ratio of thermal to magnetic pressure) regime, where turbulent dissipation is balanced by two idealized cooling functions (approximating linear cooling and free–free emission) and examine the impact of the equation of state by considering cases that correspond to isothermal, monatomic, and diatomic gases. We find a strong anticorrelation between thermal and magnetic pressure independent of thermodynamics, whereas the strong anticorrelation between density and magnetic field found in the isothermal case weakens with increasing γ. Similarly, the linear relation between variations in density and thermal pressure with sonic Mach number becomes steeper with increasing γ. This suggests that there exists a degeneracy in these relations with respect to thermodynamics and Mach number in this regime, which is dominated by slow magnetosonic modes. These results have implications for attempts to infer (e.g.,) Mach numbers from (e.g.,) Faraday rotation measurements, without additional information regarding the thermodynamics of the plasma. However, our results suggest that this degeneracy can be broken by utilizing higher-order moments of observable distribution functions.
Soil organic matter diagenetic state informs boreal forest ecosystem feedbacks to climate change
The fate of soil organic carbon (SOC) in boreal forests is dependent on the integrative ecosystem response to climate change. For example, boreal forest productivity is often nitrogen (N) limited, and climate warming can enhance N cycling and primary productivity. However, the net effect of this feedback on the SOC reservoir and its longevity with climate change remain unclear due to difficulty in detecting small differences between large and variable carbon (C) fluxes needed to determine net changes in soil reservoirs. The diagenetic state of SOC – resulting from the physicochemical and biological transformations that alter the original biomolecular composition of detrital inputs to soil over time – is useful for tracing the net response of SOC at the timescales relevant to climate change not usually discernible from fluxes and stocks alone. Here, we test two hypotheses using a mesic boreal forest climate transect: (1) the SOC diagenetic state is maintained across this climosequence, and (2) the maintenance of the SOC diagenetic state is a consequence of coupled soil C and N cycling, signifying the role of enhanced N cycling supporting SOC inputs that maintain SOC stocks within the warmer-climate forests. Shifts in nonvascular to vascular plant inputs with climate observed in these and other boreal forests highlighted the need to carefully separate biogeochemical indicators of SOC source from those signifying diagenetic alteration. We thus evaluated and applied lignin biomarkers to assess the diagenetic alteration of SOC in these boreal forest organic soils and directly compared the lignin diagenetic state with that of soil organic nitrogen (SON) assessed through amino acid composition. The lignin diagenetic state remained constant across the climate transect, indicating a balance between the input and removal of lignin in these mesic boreal forests. When combined with previous knowledge of these forest ecosystems, including the diagenetic state of SON and direct measures of C fluxes and stocks, the results indicate a coupled increase in C and N cycling with climate warming that supports forest productivity and maintains SOC stocks. This balance could markedly shift as other factors begin to limit forest productivity (e.g., trace nutrients, water) with further climate change or affect forest nutrient allocation (e.g., forest age or compositional change). Further application of the approach presented here could be used to detect the limits of this and other ecosystem–climate feedbacks, by providing a tractable and parameterizable index of the lignin state across large spatial scales, necessary for ecosystem-scale parameterizations.
Fusion Science Center for Extreme States of Matter
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Hot and dense matter equation of state probability distributions for astrophysical simulations
We add an ensemble of nuclei to the equation of state for homogeneous nucleonic matter to generate a new set of models suitable for astrophysical simulations of core-collapse supernovae and neutron star mergers. We implement empirical constraints from (i) nuclear mass measurements, (ii) proton-proton scattering phase shifts, and (iii) neutron star observations. Our model is also guided by microscopic many-body theory calculations based on realistic nuclear forces, including the zero-temperature neutron matter equation of state from quantum Monte Carlo simulations and thermal contributions to the free energy from finite-temperature many-body perturbation theory. We ensure that the parameters of our model can be varied while preserving thermodynamic consistency and the connection to experimental or observational data, thus providing a probability distribution of the astrophysical hot and dense matter equation of state. Furthermore, we compare our results with those obtained from other available equations of state. While our probability distributions indeed represent a large number of possible equations of state, we cannot yet claim to have fully explored all of the uncertainties, especially with regard to the structure of nuclei in the hot and dense medium.
Determination of the finite temperature equation of state of dense matter
The equation of state is calculated for temperatures less than 30 MeV and densities less than four times the saturation density of nuclear matter using a combined analysis of Auxiliarly Fields Diffusion Monte Carlo and Fermi Hypernetted Change methods.
Combined x-ray scattering, radiography, and velocity interferometry/streaked optical pyrometry measurements of warm dense carbon using a novel technique of shock-and-release
This work focused on a new application of the shock-and-release technique for equation of state (EOS) measurements. Warm dense matter states at near normal solid density and at temperatures close to 10 eV in diamond and graphite samples were created using a deep release from a laser-driven shock at the OMEGA laser facility. Independent temperature, density, and pressure measurements that do not depend on any theoretical models or simulations were obtained using imaging x-ray Thomson scattering, radiography, velocity interferometry, and streaked optical pyrometry. The experimental results were reproduced by the 2-D FLASH radiation hydrodynamics simulations finding a good agreement. The final EOS measurement was then compared with widely used SESAME EOS models as well as quantum molecular dynamics simulation results for carbon, which were very consistent with the experimental data.
Island for gravitationally prepared state and pseudo entanglement wedge
We consider spacetime initiated by a finite-sized initial boundary as a generalization of the Hartle-Hawking no-boundary state. We study entanglement entropy of matter state prepared by such spacetime. We find that the entanglement entropy for large subregion is given either by the initial state entanglement or the entanglement island, preventing the entropy to grow arbitrarily large. Consequently, the entanglement entropy is always bounded from above by the boundary area of the island, leading to an entropy bound in terms of the island. The island I is located in the analytically continued spacetime, either at the bra or the ket part of the spacetime in Schwinger-Keldysh formalism. The entanglement entropy is given by an average of complex pseudo generalized entropy for each entanglement island. We find a necessary condition of the initial state to be consistent with the strong sub-additivity, which requires that any probe degrees of freedom are thermally entangled with the rest of the system. We then find a large parameter region where the spacetime with finite-sized initial boundary, which does not have the factorization puzzle at leading order, dominates over the Hartle-Hawking no-boundary state or the bra ket wormhole. Due to the absence of a moment of time reflection symmetry, the island in our setup is a generalization of the entanglement wedge, called pseudo entanglement wedge. In pseudo entanglement wedge reconstruction, we consider reconstructing the bulk matter transition matrix on A ∪ I, from a fine-grained state on A. The bulk transition matrix is given by a thermofield double state with a projection by the initial state. We also provide an AdS/BCFT model by considering EOW branes with corners. We also find the exponential hardness of such reconstruction task using a generalization of Python’s lunch conjecture to pseudo generalized entropy.
Impact of the neutron matter equation of state on neutron skins and neutron drip lines in chiral effective field theory
Not Available
Critical examination of constraints on the equation of state of dense matter obtained from GW170817
The correlation of the tidal polarizabilities Λ 1 - Λ 2 for GW170817 is predicted by combining dense-matter equations of state (EOSs) that satisfy nuclear physics constraints with the chirp mass and mass asymmetry for this event. Our models are constrained by calculations of the neutron-matter EOS using chiral effective field theory Hamiltonians with reliable error estimates up to once or twice the nuclear saturation density. In the latter case, we find that GW170817 does not improve our understanding of the EOS. We contrast two distinct extrapolations to higher density: a minimal model (MM) which assumes that the EOS is a smooth function of density described by a Taylor expansion and a more general model parametrized by the speed of sound that admits phase transitions. This allows us to identify regions in the Λ 1 - Λ 2 plots that could favor the existence of new phases of matter in neutron stars. We predict the combined tidal polarizability of the two neutron stars in GW170817 to be 80 ≤ $\tilde{Λ}$ ≤ 580 ( 280 ≤$\tilde{Λ}$ ≤ 480 for the MM), which is smaller than the range suggested by the LIGO-Virgo data analysis. Our analysis also shows that GW170817 requires a NS with M = 1.4 M ⊙ to have a radius 9.0 km < R 1.4 < 13.6 km ( 11.3 km < R 1.4 < 13.6 km for the MM).
Metastable nuclear isomers as dark matter accelerators
Inelastic dark matter and strongly interacting dark matter are poorly constrained by direct detection experiments since they both require the scattering event to deliver energy from the nucleus into the dark matter in order to have observable effects. We propose to test these scenarios by searching for the collisional deexcitation of metastable nuclear isomers by the dark matter particles. The longevity of these isomers is related to a strong suppression of γ- and β-transitions, typically inhibited by a large difference in the angular momentum for the nuclear transition. The collisional deexcitation by dark matter is possible since heavy dark matter particles can have a momentum exchange with the nucleus comparable to the inverse nuclear size, hence lifting tremendous angular momentum suppression of the nuclear transition. This deexcitation can be observed either by searching for the direct effects of the decaying isomer, or through the rescattering or decay of excited dark matter states in a nearby conventional dark matter detector setup. Existing nuclear isomer sources such as naturally occurring 180m Ta, 137m Ba produced in decaying Cesium in nuclear waste, 177m Lu from medical waste, and 178m Hf from the Department of Energy storage can be combined with current dark matter detector technology to search for this class of dark matter.
Nanostructured $\mathrm{GaAs/(Al,Ga)As}$ Waveguide for Low-Density Polariton Condensation from a Bound State in the Continuum
Exciton-polaritons are hybrid light-matter states that arise from strong coupling between an exciton resonance and a photonic cavity mode. As bosonic excitations, they can undergo a phase transition to a condensed state that can emit coherent light without a population inversion. This aspect makes them good candidates for thresholdless lasers, yet short exciton-polariton lifetime has made it difficult to achieve condensation at very low power densities. In this sense, long-lived symmetry-protected states are excellent candidates to overcome the limitations that arise from the finite mirror reflectivity of monolithic microcavities. In this work we use a photonic symmetry-protected bound state in the continuum coupled to an excitonic resonance to achieve state-of-the-art polariton condensation threshold in a GaAs/(Al,Ga)As waveguide. Most important, we show the influence of fabrication control and how surface passivation via atomic layer deposition provides a way to reduce exciton quenching at the grating sidewalls.