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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 19 records
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

New scattering features in non-Hermitian space fractional quantum mechanics

Highlights: • Space fraction quantum mechanics (SFQM) has been investigated with complex delta and barrier potentials. • New scattering features due to these potentials are obtained in SFQM. • Spectral Singular (SS) points are blue/red shifted when Levy index is decreased. • The oscillations in scattering coefficients around SS have interesting behaviors in SFQM. • Deeper relations between the scattering properties in standard QM and those of in SFQM are observed. - Abstract: The spectral singularity (SS) and coherent perfect absorption (CPA) have been extensively studied over the last one and half decade for different non-Hermitian potentials in non-Hermitian standard quantum mechanics (SQM) governed by Schrödinger equation. In the present work we explore these scattering features in the domain of non-Hermitian space fractional quantum mechanics (SFQM) governed by fractional Schrödinger equation which is characterized by Levy index α (1<α≤2). We observe that non-Hermitian SFQM systems have more flexibility for SS and CPA and display some new features of scattering. For the delta potential V(x)=iρδ(x−x{sub 0}), ρ>0, the SS energy, E{sub ss}, is blue or red shifted with decreasing α depending on the strength of the potential. For complex rectangular barrier in non-Hermitian SQM, it is known that the reflection and transmission amplitudes are oscillatory near the spectral singular point. It is found that these oscillations eventually develop SS in non-Hermitian SFQM. The similar features are also reported for the case of CPA phenomena from complex rectangular barrier in non-Hermitian SFQM. These observations suggest a deeper relation between scattering features of non-Hermitian SQM and non-Hermitian SFQM.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2017

Approximating tunneling rates in multi-dimensional field spaces

Quantum mechanics makes the otherwise stable vacua of a theory metastable through the nucleation of bubbles of the new vacuum. This in turn causes a first order phase transition. These cosmological phase transitions may have played an important role in settling our universe into its current vacuum, and they may also happen in future. The most important frameworks where vacuum decay happens contain a large number of fields. Unfortunately, calculating the tunneling rates in these models is very time-consuming. In this paper we present a simple approximation for the tunneling rate by reducing it to a one-field problem which is easy to calculate. We demonstrate the validity of this approximation using our recent code 'Anybubble' for several classes of potentials.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

End-Use Savings Shapes Measure Documentation: Demand Control Ventilation

This documentation focuses on a single end-use savings shape measure - Demand Control Ventilation (DCV). DCV can save energy by reducing the rate at which outdoor air (OA) is delivered during periods of less-than-design occupancy. This measure will enable DCV for air loops using applicable HVAC system types (all except dedicated outdoor air systems [DOAS], packaged systems, or that have an energy recovery ventilator [ERV]) and serving applicable space types (all except kitchens, dining areas, patient spaces, mechanical rooms, stairwells and corridors, or high exhaust space types) using model occupancy schedules to control the DCV. The measure is applicable to 72.7% of the stock floor area. As office buildings outside of California in ComStock are modeled using a single, whole-building space type, DCV is not applied to these building types. The DCV measure demonstrates 2.6% total site energy savings (119 trillion British thermal units [TBtu]) for the U.S. commercial building stock modeled in ComStock.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2018

Quantum mechanics on phase space: The hydrogen atom and its Wigner functions

Symplectic quantum mechanics (SQM) considers a non-commutative algebra of functions on a phase space Γ and an associated Hilbert space H{sub Γ}, to construct a unitary representation for the Galilei group. From this unitary representation the Schrödinger equation is rewritten in phase space variables and the Wigner function can be derived without the use of the Liouville–von Neumann equation. In this article the Coulomb potential in three dimensions (3D) is resolved completely by using the phase space Schrödinger equation. The Kustaanheimo–Stiefel(KS) transformation is applied and the Coulomb and harmonic oscillator potentials are connected. In this context we determine the energy levels, the amplitude of probability in phase space and correspondent Wigner quasi-distribution functions of the 3D-hydrogen atom described by Schrödinger equation in phase space.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2017

Electronic Delocalization, Vibrational Dynamics and Energy Transfer in Organic Chromophores

The efficiency of materials developed for solar energy and technological applications depends on the interplay between molecular architecture and light-induced electronic energy redistribution. The spatial localization of electronic excitations is very sensitive to molecular distortions. Vibrational nuclear motions can couple to electronic dynamics driving changes in localization. The electronic energy transfer among multiple chromophores arises from several distinct mechanisms that can give rise to experimentally measured signals. Atomistic simulations of coupled electron-vibrational dynamics can help uncover the nuclear motions directing energy flow. Through careful analysis of excited state wave function evolution and a useful fragmenting of multichromophore systems, through-bond transport and exciton hopping (through-space) mechanisms can be distinguished. Such insights are crucial in the interpretation of fluorescence anisotropy measurements and can aid materials design. Finally, this Perspective highlights the interconnected vibrational and electronic motions at the foundation of nonadiabatic dynamics where nuclear motions, including torsional rotations and bond vibrations, drive electronic transitions.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Tribological Behavior of Pulsed Electrodeposited Ni-W/SiC Nanocomposites

Ni-14 at.% W/SiC nanocomposite coatings containing 0-6 vol.% of submicron size (0.35 μm) SiC particles were obtained using pulsed electrodeposition technique on mild steel substrate. The coatings were subsequently characterized for uniformity of SiC distribution, grain size and mechanical properties (hardness and elastic modulus) using SEM, XRD and nanoindentation techniques, respectively. It was observed that the SiC particulates were uniformly distributed within the coating. The coating matrix (Ni-W) also exhibited nanograin size. Tribological behavior of Ni-14 W/SiC nanocomposite was analyzed under dry sliding wear test conditions using pin on disk method. The interrelationship between SiC content, interparticle spacing, mechanical properties and wear behavior was analyzed. The results suggest that whereas hardness and modulus of nanocomposite coatings varied with SiC content as per Rule of Mixtures, wear mechanism can be best explained on the basis of Inverse Rule of Mixtures.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2016

Influence of phase composition on microstructure and properties of Mg-5Al-0.4Mn-xRE (x = 0, 3 and 5 wt.%) alloys

The microstructure and mechanical properties investigations of two AME503 and AME505 experimental alloys in as-cast conditions were presented. The investigated materials were fabricated on the basis of the AM50 commercial magnesium alloy with 3 and 5 wt.% cerium rich mischmetal. In the as-cast condition, both experimental alloys were mainly composed of α-Mg, Al{sub 11}RE{sub 3} and Al{sub 10}RE{sub 2}Mn{sub 7} intermetallic phases. Additionally, due to non-equilibrium solidification conditions, a small amount of α + γ divorced eutectic and Al{sub 2}RE intermetallic phase were revealed. The obtained results also show a significant influence of rare earth elements on Brinell hardness, tensile and compression properties at ambient temperature and especially on creep properties at 473 K. Improved alloy properties with a rise in rare earth elements mass fraction results from an increase in Al{sub 11}RE{sub 3} phase volume fraction and suppression of α + γ eutectic volume fraction in the alloy microstructure. Additionally, the influence of rare earth elements on the dendrite arm space value was discussed. The presented results also proved the thermal stability of the intermetallic phases during creep testing. - Highlights: • Two different Mg-5Al-0.4Mn alloys containing 3 and 5 wt.% of rare earth elements were fabricated. • Addition of rare earth elements leads to a reduction of dendrite arm spaces. • Mechanical properties depend on the phase composition of the alloys. • The increase of the rare earth elements content causes rise of the creep resistance.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Pollen Cell Wall Patterns Form from Modulated Phases

The ornately geometric walls of pollen grains have inspired scientists for decades. Here, we show that the evolved diversity of these patterns is entirely recapitulated by a biophysical model in which an initially uniform polysaccharide layer in the extracellular space, mechanically coupled to the cell membrane, phase separates to a spatially modulated state. Experiments reveal this process occurring in living cells. We observe that in ~10% of extant species, this phase separation reaches equilibrium during development such that individual pollen grains are identical and perfectly reproducible. About 90% of species undergo an arrest of this process prior to equilibrium such that individual grains are similar but inexact copies. Equilibrium patterns have appeared multiple times during the evolution of seed plants, but selection does not favor these states. This framework for pattern development provides a route to rationalizing the surface textures of other secreted structures, such as cell walls and insect cuticle.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2016

Applications of rigged Hilbert spaces in quantum mechanics and signal processing

Simultaneous use of discrete and continuous bases in quantum systems is not possible in the context of Hilbert spaces, but only in the more general structure of rigged Hilbert spaces (RHS). In addition, the relevant operators in RHS (but not in Hilbert space) are a realization of elements of a Lie enveloping algebra and support representations of semigroups. We explicitly construct here basis dependent RHS of the line and half-line and relate them to the universal enveloping algebras of the Weyl-Heisenberg algebra and su(1, 1), respectively. The complete sub-structure of both RHS and of the operators acting on them is obtained from their algebraic structures or from the related fractional Fourier transforms. This allows us to describe both quantum and signal processing states and their dynamics. Two relevant improvements are introduced: (i) new kinds of filters related to restrictions to subspaces and/or the elimination of high frequency fluctuations and (ii) an operatorial structure that, starting from fix objects, describes their time evolution.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2021

Quantum space, quantum time, and relativistic quantum mechanics

We treat space and time as bona fide quantum degrees of freedom on an equal footing in Hilbert space. Motivated by considerations in quantum gravity, we focus on a paradigm dealing with linear, first-order Hamiltonian and momentum constraints that lead to emergent features of temporal and spatial translations. Unlike the conventional treatment, we show that Klein-Gordon and Dirac equations in relativistic quantum mechanics can be unified in our paradigm by applying relativistic dispersion relations to eigenvalues rather than treating them as operator-valued equations. With time and space being treated on an equal footing in Hilbert space, we show symmetry transformations to be implemented by unitary basis changes in Hilbert space, giving them a stronger quantum mechanical footing. Global symmetries, such as Lorentz transformations, modify the decomposition of Hilbert space; and local symmetries, such as U(1) gauge symmetry are diagonal in coordinate basis and do not alter the decomposition of Hilbert space. Here, we briefly discuss extensions of this paradigm to quantum field theory and quantum gravity.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2017

A compliant mechanism for inspecting extremely confined spaces

We present here a novel, compliant mechanism that provides the capability to navigate extremely confined spaces for the purpose of infrastructure inspection. Extremely confined spaces are commonly encountered during infrastructure inspection. Examples of such spaces can include pipes, conduits, and ventilation ducts. Often these infrastructure features go uninspected simply because there is no viable way to access their interior. In addition, it is not uncommon for extremely confined spaces to possess a maze-like architecture that must be selectively navigated in order to properly perform an inspection. Efforts by the imaging sensor community have resulted in the development of imaging sensors on the millimeter length scale. Due to their compact size, they are able to inspect many extremely confined spaces of interest, however, the means to deliver these sensors to the proper location to obtain the desired images are lacking. To address this problem, we draw inspiration from the field of endoscopic surgery. Specifically we consider the work that has already been done to create long flexible needles that are capable of being steered through the human body. These devices are typically referred to as 'steerable needles.' Steerable needle technology is not directly applicable to the problem of navigating maze-like arrangements of extremely confined spaces, but it does provide guidance on how this problem should be approached. Specifically, the super-elastic nitinol tubing material that allows steerable needles to operate is also appropriate for the problem of navigating maze-like arrangements of extremely confined spaces. Furthermore, the portion of the mechanism that enters the extremely confined space is completely mechanical in nature. The mechanical nature of the device is an advantage when the extremely confined space features environmental hazards such as radiation that could degrade an electromechanically operated mechanism. Here, we present a compliant mechanism developed to navigate maze-like arrangements of extremely confined spaces. The mechanism is shown to be able to selectively navigate past three 90° bends. The ability to selectively navigate extremely confined spaces opens up new possibilities to use emerging miniature imaging technology for infrastructure inspection.

47 OTHER INSTRUMENTATION↗
DOE OSTI2016

Multiscale real-space quantum-mechanical tight-binding calculations of electronic structure in crystals with defects using perfectly matched layers

Graphical abstract: - Abstract: We consider the scattering of incident plane-wave electrons from a defect in a crystal modeled by the time-harmonic Schrödinger equation. While the defect potential is localized, the far-field potential is periodic, unlike standard free-space scattering problems. Previous work on the Schrödinger equation has been almost entirely in free-space conditions; a few works on crystals have been in one-dimension. We construct absorbing boundary conditions for this problem using perfectly matched layers in a tight-binding formulation. Using the example of a point defect in graphene, we examine the efficiency and convergence of the proposed absorbing boundary condition.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Structural and functional impact of troponin C-mediated Ca 2+ sensitization on myofilament lattice spacing and cross-bridge mechanics in mouse cardiac muscle

Acto-myosin cross-bridge kinetics are important for beat-to-beat regulation of cardiac contractility; however, physiological and pathophysiological mechanisms for regulation of contractile kinetics are incompletely understood. Here we explored whether thin filament-mediated Ca 2+ sensitization influences cross-bridge kinetics in permeabilized, osmotically compressed cardiac muscle preparations. We used a murine model of hypertrophic cardiomyopathy (HCM) harboring a cardiac troponin C (cTnC) Ca 2+ -sensitizing mutation, Ala8Val in the regulatory N-domain. We also treated wild-type murine muscle with bepridil, a cTnC-targeting Ca 2+ sensitizer. Our findings suggest that both methods of increasing myofilament Ca 2+ sensitivity increase cross-bridge cycling rate measured by the rate of tension redevelopment (k TR ); force per cross-bridge was also enhanced as measured by sinusoidal stiffness and I 1,1 -1/I 1,0 ratio from X-ray diffraction. Computational modeling suggests that Ca 2+ sensitization through this cTnC mutation or bepridil accelerates k TR primarily by promoting faster cross-bridge detachment. To elucidate if myofilament structural rearrangements are associated with changes in k(TR), we used small angle X-ray diffraction to simultaneously measure myofilament lattice spacing and isometric force during steady-state Ca 2+ activations. Within in vivo lattice dimensions, lattice spacing and steady-state isometric force increased significantly at submaximal activation. We conclude that the cTnC N-domain controls force by modulating both the number and rate of cycling cross-bridges, and that the both methods of Ca 2+ sensitization may act through stabilization of cTnC's D-helix. Furthermore, we propose that the transient expansion of the myofilament lattice during Ca 2+ activation may be an additional factor that could increase the rate of cross-bridge cycling in cardiac muscle. These findings may have implications for the pathophysiology of HCM.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2020

Direct evidence that tumor cells soften when navigating confined spaces.

The mechanical properties of cells strongly regulate many physiological and pathological processes. For example, in cancer, invasive and metastatic tumor cells have often been reported to be softer than nontumor cells, raising speculation that cancer cells might adaptively soften to facilitate migration through narrow tissue spaces. Despite growing interest in targeting cell softening to impede invasion and metastasis, it remains to be directly demonstrated that tumor cells soften as they migrate through confined spaces. Here, we address this open question by combining topographically patterned substrates with atomic force microscopy (AFM). Using a polydimethylsiloxane open-roof microdevice featuring tapered, fibronectin-coated channels, we followed the migration of U2OS cells through various stages of confinement while simultaneously performing AFM indentation. As cells progress from unconfined migration to fully confined migration, cells soften and exclude Yes-associated protein from the nucleus. Superresolution imaging reveals that confinement induces remodeling of actomyosin stress fiber architecture. Companion studies with flat one-dimensional microlines indicate that the changes in cytoarchitecture and mechanics are intrinsically driven by topographical confinement rather than changes in cellular aspect ratio. Our studies represent among the most direct evidence to date that tumor cells soften during confined migration and support cell softening as a mechanoadaptive mechanism during invasion.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2015

Measurement incompatibility and Schrödinger-Einstein-Podolsky-Rosen steering in a class of probabilistic theories

Steering is one of the most counter intuitive non-classical features of bipartite quantum system, first noticed by Schrödinger at the early days of quantum theory. On the other hand, measurement incompatibility is another non-classical feature of quantum theory, initially pointed out by Bohr. Recently, Quintino et al. [Phys. Rev. Lett. 113, 160402 (2014)] and Uola et al. [Phys. Rev. Lett. 113, 160403 (2014)] have investigated the relation between these two distinct non-classical features. They have shown that a set of measurements is not jointly measurable (i.e., incompatible) if and only if they can be used for demonstrating Schrödinger-Einstein-Podolsky-Rosen steering. The concept of steering has been generalized for more general abstract tensor product theories rather than just Hilbert space quantum mechanics. In this article, we discuss that the notion of measurement incompatibility can be extended for general probability theories. Further, we show that the connection between steering and measurement incompatibility holds in a border class of tensor product theories rather than just quantum theory.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Model of Four-Dimensional Sub-Proton Euclidean Space with Real Time for Valence Quarks. Lagrangian Mechanics

The model of Euclidean space with imaginary time used in sub-hadron physics uses only part of it since this part is isomorphic to Minkowski space and has the velocity limit 0 ≤ ||v{sub Ei}|| ≤ 1. The model of four-dimensional Euclidean space with real time (Е space), in which 0 ≤ ||v{sub E}|| ≤ ∞ is investigated. The vectors of this space have Е-invariants, equal or analogous to the invariants of Minkowski space. All relations between physical quantities in Е-space, after they are mapped into Minkowski space, satisfy the principles of SRT and are Lorentz-invariant, and the velocity of light corresponds to infinite velocity. Results obtained in the model are different from the physical laws in Minkowski space. Thus, from the model of the Lagrangian mechanics of quarks in a centrally symmetric attractive potential it follows that the energy-mass of a quark decreases with increase of the velocity and is equal to zero for v = ∞. This made it possible to establish the conditions of emission and absorption of gluons by quarks. The effect of emission of gluons by high-energy quarks was discovered experimentally significantly earlier. The model describes for the first time the dynamic coupling of the masses of constituent and current quarks and reveals new possibilities in the study of intrahardon space. The classical trajectory of the oscillation of quarks in protons is described.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗