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At least 1,099 records · Page 61

Global minimization via classical tunneling assisted by collective force field formation

Simple elements interacting in networks can give rise to intricate emergent behaviors. Examples such as synchronization and phase transitions often apply in many contexts, as many different systems may reduce to the same effective model. Here, we demonstrate such a behavior in a model inspired by memristors. When weakly driven, the system is described by movement in an effective potential, but when strongly driven, instabilities cause escapes from local minima, which can be interpreted as an unstable tunneling mechanism. We dub this collective and nonperturbative effect a “Lyapunov force,” which steers the system toward the global minimum of the potential function, even if the full system has a constellation of equilibrium points growing exponentially with the system size. This mechanism is appealing for its physical relevance in nanoscale physics and for its possible applications in optimization, Monte Carlo schemes, and machine learning.

97 MATHEMATICS AND COMPUTING↗

Relativistic collapse of the classical triple bond in the CBi − molecular ion

The conventional framework for chemical bonding between main-group elements involves separate σ and π orbitals to describe multiple bonds. However, relativistic effects mix these orbitals in molecules containing heavy elements through spin–orbit coupling, leaving the total angular-momentum projection (ω) as the only good quantum number. Direct experimental evidence that relativistic effects change the σ-π bonding framework has remained elusive. Here, we probe the carbon-bismuth triple bond in the CBi − anion using high-resolution cryogenic photoelectron spectroscopy, coupled with relativistic four-component Dirac-Coulomb coupled-cluster calculations. Furthermore, even though the CBi − anion is isovalent to the well-known CN − species, we demonstrate that the traditional σ + 2π triple-bond picture collapses into a pure π-like |ω| = 3/2 and two |ω| = 1/2 Kramers pairs containing substantial σ/π mixing.

Kahraman, Deniz [Brown University, Providence, RI ↗

Classical gluon fields and collective dynamics of color-charge systems

An investigation of color fields that arise in collisions of relativistic heavy ions reveals that, in the non-Abelian case, a change in the color charge leads to the appearance of an extra term that generates a sizable contribution of color-charge glow in chromoelectric and chromomagnetic fields. The possibility of the appearance of a color echo in the scattering of composite color particles belonging to the dipole type is discussed. Arguments are adduced in support of the statement that such effects are of importance in simulating the first stage of ultrarelativistic heavy-ion collisions,where the initial parton state is determined by a high nonequilibrium parton density and by strong local color fluctuations.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Classical integrable many-body systems disconnected with semi-simple Lie algebras

The review of the results in the theory of integrable many-body systems disconnected with semisimple Lie algebras is done. The one-dimensional systems of light Calogero-Sutherland-Moser particles interacting with one particle of infinite mass located at the origin are described in detail. In some cases the exact solutions of the equations of motion are obtained. The general theory of integration of the equations of motion needs the methods of algebraic geometry. The Lax pairs with spectral parameter are constructed for this purpose. The theory still contains many unsolved problems.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Tensoresistance of n-Ge with different crystallographic orientations in the presence of a classically high magnetic field and without it

Variations in the tensoresistance, tensomagnetoresistance, and magnetotensoresistance are experimentally and theoretically studied in wide ranges of magnetic-field strengths, 0 kOe ≤ H ≤ 100 kOe, and mechanical stresses, 0 GPa ≤ X ≤ 0.7 GPa, at 77 K under conditions of nondegenerate statistics of the electron gas in n-Ge crystals with different crystallographic orientations.

36 MATERIALS SCIENCE↗

Electro-optic sampling of classical and quantum light

Full characterization of electric-field waveforms in amplitude and phase is achieved across the terahertz to visible spectral range through interaction with an optical pulse shorter than a half-cycle period via the Pockels (linear electro-optic) effect. This technique of electro-optic sampling has become an indispensable tool in various areas, including ultrafast pump-probe, time-domain and frequency-comb spectroscopies, quantum optics, high-harmonic generation, and attosecond science, and holds great promise for further advances. Not only does it enable spectroscopic measurements with record dynamic range and temporal resolution, along with massively parallel real-time spectral data acquisition, but its remarkable sensitivity also allows the detection of vacuum fluctuations, i.e., “zero-point motion” of electric fields, profoundly impacting our understanding of the fundamental laws of nature.

Benea-Chelmus, Ileana-Cristina (ORCID:000000024814↗

Classical and quantum temperature fluctuations via holography

We study local temperature fluctuations in a 2+1 dimensional CFT on the sphere, dual to a black hole in asymptotically AdS space-time. The fluctuation spectrum is governed by the lowest-lying hydrodynamic sound modes of the system whose frequency and damping rate determine whether temperature fluctuations are thermal or quantum. We calculate numerically the corresponding quasinormal frequencies and match the result with the hydrodynamics of the dual CFT at large temperature. As a by-product of our analysis we determine the appropriate boundary conditions for calculating low-lying quasinormal modes for a four-dimensional Reissner-Nordstrom black hole in global AdS.

79 ASTRONOMY AND ASTROPHYSICS↗

Classic Nuclear Fuel Reprocessing Flowsheet

This is a flowsheet as well as a series of subsheets to be used for discussion on the standard design of a reprocessing plant. This flowsheet consists of four main sections: offgas handling, separations, solvent wash, and acid recycle. As well as having the main flowsheet, subsections have been broken off into their own sheets to provide for larger font and ease of printing.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Cuprous Oxide Scale up: Gram Production via Bulk Synthesis using Classic Solvents at Low Temperatures

Cuprous oxide is a p-type semiconducting material that has been highly researched for its interesting properties. Many small-scale syntheses have exhibited excellent control over size and morphology. As the demand for cuprous oxide grows, the synthesis method need to evolve to facilitate large-scale production. This paper supplies a facile bulk synthesis method for Cu₂O on average, 1-liter reaction volume can produce 1 gram of particles. In order to study the shape and size control mechanisms on such a scale, the reaction volume was diminished to 250 mL producing on average 0.3 grams of nanoparticles per batch. Well-shaped nanoparticles have been synthesized using an aqueous solution of CuCl₂, NaOH, SDS surfactant, and NH₂OH-HCl at mild temperatures. The time allotted between the addition of NaOH and NH₂OH-HCl was determined to be critical for Cu(OH)2 production, an important precursor to the final produce The effects of stirring rates on a large scale was also analyzed during reagent addition and post reagent addition. A morphological change from rhombic dodecahedra to spheres occurred as the stirring speed was increased. The effects of NH₂OH-HCl concentration were also studied to control the etching effects of the final product.

36 MATERIALS SCIENCE↗

Bridging the Gap Between Quantum Chemistry and Classical Simulations for CO 2 Capture

We have developed a systematic procedure to generate transferable force fields to simulate the behavior of CO 2 and other gases in open-metal-site metal organic frameworks using high-level quantum chemical calculations. Monte Carlo simulations based on an ab initio force field for CO 2 in the Mg 2 (dobpdc) material have been employed to describe the interactions of CO 2 with open metals. Our study has shed some light on the interpretation of thermodynamic data of flue gas in Mg 2 (dobpdc). This force field accurately describes the chemistry of the open metal sites, and is transferable to other structures.

20 FOSSIL-FUELED POWER PLANTS↗

Semi-classical Electrodynamics: A Short Note

I have previously claimed the key to understanding the numerical value of the fine structure constant is near-field corrections which terminate integrals at low virtual photon energies, thus obverting an infrared divergence common to many QED calculations. I have since switched to a physics-based calculation of the near-field corrections, instead of the previously used educated guess. The relevant equations are presented here.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Neutron Scattering Studies of Classical and Quantum Fluids in Porous Media

This is an annual and the final report on DE-FG02-03ER46038 (ER46680) following a no cost extension of DE-FG02-03ER46038 from February 16, 2016 to November 15, 2016. The report period is February 16, 2016 to November 15, 2016. The contract DE-FG02-03ER46038 (ER46680) was closed on November 15, 2016. The contract institution is the University of Delaware, address: Room 210, Hullihen %%@ Hall, University of Delaware, Newark, DE 19716. The Principal Investigator is Henry R. Glyde, Department of Physics and Astronomy, University of Delaware, Newark, DE 19716 (email: glyde@udel.edu). The Administrative Point of Contact is Dale S. Weiss Tel: 302 831 3634 dsweiss@udel.edu. The DOE Program is the Office of Basic Energy %%@ Sciences, U.S. Department of Energy, Germantown Building, 1000 Independence Ave., SW Washington, DC 20585. The program manager is Dr. P. Thiyagarajan, Neutron Scattering SC-22.2/ Germantown Bldg., Tel: 301-903-9706, email: P. Thiyagarajan@Science.DOE.GOV.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Predicting thermodynamic and thermophysical properties of molten chloride salts from ab-initio and classical molecular dynamics simulations

Molten salt reactors (MSRs) are among the advanced concepts pursued under the generation IV nuclear energy technology umbrella. However, the basic concept is not new and was first developed as part of the effort to power aircrafts with nuclear energy in the 1950’s. Later in the 1960’s, Oak Ridge National Laboratory (ORNL) built and operated the Molten-Salt Reactor Experiment (MSRE). This reactor used a fluoride salt with uranium as fuel. Fluorides salts are still highly relevant and proposed in several designs. In addition, chloride salts are being considered for MSRs operating in the fast neutron spectrum. This report focuses on chloride salts.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗