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DOE OSTI2017

Joint DIII-D/EAST research on the development of a high poloidal beta scenario for the steady state missions of ITER and CFETR

Experimental and modeling investigations on the DIII-D and EAST tokamaks show the attractive transport and stability properties of fully noninductive, high poloidal-beta (β P ) plasmas, and their suitability for steady-state operating scenarios in ITER and CFETR. A key feature of the high-β P regime is the large-radius (r>0.6) internal transport barrier (ITB), often observed in all channels (ne, Te, Ti, rotation), and responsible for both excellent energy confinement quality and excellent stability properties. Experiments on DIII-D have shown that, with a largeradius ITB, very high β N and β P values (both≥4) can be reached by taking advantage of the stabilizing effect of a nearby conducting wall. Synergistically, higher plasma pressure provides turbulence suppression by Shafranov shift, leading to ITB sustainment independent of the plasma rotation. Experiments on EAST have been used to assess the long pulse potential of the high-β P regime. Using RF-only heating and current drive, EAST achieved minute-long fully noninductive steady state H-mode operation with strike points on an ITER-like tungsten divertor. Improved confinement (relative to standard H-mode) and steady state ITB features are observed with a monotonic q-profile with q min ~1.5. Separately, experiments have shown that increasing the density in plasmas driven by lower hybrid wave broadens the q-profile, a technique that could enable a large radius ITB. These experimental results have been used to validate MHD, current drive, and turbulent transport models, and to project the high-β P regime to a burning plasma. These projections suggest the Shafranov shift alone will not suffice to provide improved confinement (over standard H-mode) without rotation and rotation shear. However, increasing the negative magnetic shear (higher q on axis) provides a similar turbulence suppression mechanism to Shafranov shift, and can help devices such as ITER and CFETR achieve their steady-state fusion goals.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2012

ARE PULSING SOLITARY WAVES RUNNING INSIDE THE SUN?

A precise sequence of frequencies-detected four independent ways-is interpreted as a system of solitary waves below the Sun's convective envelope. Six future observational or theoretical tests of this idea are suggested. Wave properties (rotation rates, radial energy distribution, nuclear excitation strength) follow from conventional dynamics of global oscillation modes after assuming a localized nuclear term strong enough to perturb and hold mode longitudes into alignments that form 'families'. To facilitate future tests, more details are derived for a system of two dozen solitary waves 2 {<=} l {<=} 25. Wave excitation by {sup 3}He and {sup 14}C burning is complex. It spikes by factors M{sub 1} {<=} 10{sup 3} when many waves overlap in longitude but its long-time average is M{sub 2} {<=} 10. Including mixing can raise overall excitation to {approx}50 times that in a standard solar model. These spikes cause tiny phase shifts that tend to pull wave rotation rates toward their ideal values {proportional_to}[l(l + 1)]{sup -1}. A system like this would generate some extra nuclear energy in two spots at low latitude on opposite sides of the Sun. Each covers about 20 Degree-Sign of longitude. Above a certain wave amplitude, the system starts giving distinctly more nuclear excitation to some waves (e.g., l = 9, 14, and 20) than to neighboring l values. The prominence of l = 20 has already been reported. This transition begins at temperature amplitudes {Delta}T/T = 0.03 in the solar core for a typical family of modes, which corresponds to {delta}T/T {approx} 0.001 for one of its many component oscillation modes.

79 ASTRONOMY AND ASTROPHYSICS↗

DOE OSTI2016

Oxygen vacancy induced by La and Fe into ZnO nanoparticles to modify ferromagnetic ordering

We reported long-range ferromagnetic interactions in La doped Zn{sub 0.95}Fe{sub 0.05}O nanoparticles that mediated through lattice defects or vacancies. Zn{sub 0.92}Fe{sub 0.05}La{sub 0.03}O (ZFLaO53) nanoparticles were synthesized by a sol–gel process. X-ray fluorescence spectrum of ZFLaO53 detects the weight percentage of Zn, Fe, La and O. X-ray diffraction shows the hexagonal Wurtzite ZnO phase. The Rietveld refinement has been used to calculate the lattice parameters and the position of Zn, Fe, La and O atoms in the Wurtzite unit cell. The average size of ZFLaO53 nanoparticles is 99 nm. The agglomeration type product due to OH ions with La results into ZnO nanoparticles than nanorods that found in pure ZnO and Zn{sub 0.95}Fe{sub 0.05}O sample. The effect of doping concentration to induce Wurtzite ZnO structure and lattice defects has been analyzed by Raman active vibrational modes. Photoluminescence spectra show an abnormal emission in both UV and visible region, and a blue shift at near band edge is formed with doping. The room temperature magnetic measurement result into weak ferromagnetism but pure ZnO is diamagnetic. However, the temperature dependent magnetic measurement using zero-field and field cooling at dc magnetizing field 500 Oe induces long-range ferromagnetic ordering. It results into antiferromagnetic Neel temperature of ZFLaO53 at around 42 K. The magnetic hysteresis is also measured at 200, 100, 50 and 10 K measurement that indicate enhancement in ferromagnetism at low temperature. Overall, the La doping into Zn{sub 0.95}Fe{sub 0.05}O results into enhanced antiferromagnetic interaction as well as lattice defects/vacancies. The role of the oxygen vacancy as the dominant defects in doped ZnO must form Bound magnetic polarons has been described. - Graphical abstract: The long-range ferromagnetic order in Zn{sub 0.92}Fe{sub 0.05}La{sub 0.03}O nanoparticles at low temperature measurements involves oxygen vacancy as the medium of magnetic interactions. - Highlights: • The La and Fe doping into ZnO nanoparticles induce defects in terms of oxygen vacancy. • The La ions in Fe substituted ZnO formed nanoparticles than nanorods. • Antiferromagnetic interactions are observed at room temperature magnetic measurement. • Rietveld analysis evaluated structural deformation in the Wurtzite ZnO lattice.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2020

Theory of the tertiary instability and the Dimits shift within a scalar model

The Dimits shift is the shift between the threshold of the drift-wave primary instability and the actual onset of turbulent transport in a magnetized plasma. It is generally attributed to the suppression of turbulence by zonal flows, but developing a more detailed understanding calls for consideration of specific reduced models. The modified Terry–Horton system has been proposed by St-Onge ( J. Plasma Phys. , vol. 83, 2017, 905830504) as a minimal model capturing the Dimits shift. Here, we use this model to develop an analytic theory of the Dimits shift and a related theory of the tertiary instability of zonal flows. We show that tertiary modes are localized near extrema of the zonal velocity $U(x)$ , where $x$ is the radial coordinate. By approximating $U(x)$ with a parabola, we derive the tertiary-instability growth rate using two different methods and show that the tertiary instability is essentially the primary drift-wave instability modified by the local $U'' \doteq {\rm d}^2 U/{\rm d} x^2 $ . Then, depending on $U''$ , the tertiary instability can be suppressed or unleashed. The former corresponds to the case when zonal flows are strong enough to suppress turbulence (Dimits regime), while the latter corresponds to the case when zonal flows are unstable and turbulence develops. This understanding is different from the traditional paradigm that turbulence is controlled by the flow shear $| {\rm d} U / {\rm d} x |$ . Our analytic predictions are in agreement with direct numerical simulations of the modified Terry–Horton system.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2023

Multimode theory of electron hole transverse instability

We present Vlasov–Poisson three-dimensional linear stability analysis of an initially planar electron hole structure, solving for the distribution function by integration along unperturbed orbits. The non-sinusoidal potential perturbation shape (parallel to $B$ ) is expanded in eigenfunctions of the adiabatic Poisson operator, generalizing the prior assumption of a rigid shift of the equilibrium. We show that the shiftmode is then modified by a second discrete mode plus an integral over a continuum of wave-like modes. A rigorous treatment shows that the continuum can be approximated effectively by a single mode that satisfies the external wave dispersion relation, thus making the perturbation a weighted sum of three modes. We find numerically the solution for the complex instability frequency, and the corresponding three mode amplitudes determining the perturbation eigenmode. This multimode analysis refines the accuracy of the prior single-mode results, giving slightly higher growth rates at most parameters, as expected from the extra mode shape freedom. Oscillating modes near stability boundaries have larger mode distortions which help explain particle-in-cell simulations that observe instability up to ${\sim }20$ % beyond the prior shiftmode thresholds, and narrowing of the perturbation. At high magnetic field, the multimode analysis predicts a reduction of the already small growth rate.

Physics↗

DOE OSTI2020

Extracting the Frequency-Dependent Dynamic Stokes Shift from Two-Dimensional Electronic Spectra with Prominent Vibrational Coherences

The dynamic Stokes shift is a common means for characterizing ultrafast solvation dynamics of electronically excited states. Here we extract the excitation frequency-dependent dynamic Stokes shift from two-dimensional electronic spectra (2DES) of cresyl violet, a molecule with a well-defined vibronic progression. The extracted dynamic Stokes shift function, S(t), exhibits oscillatory behavior, and the oscillatory components are assigned to intramolecular vibrational modes through DFT and TD-DFT calculations. Here, the well-characterized oscillations are incorporated into the fitting procedure of S(t). The excitation frequency dependence of the ultrafast response is examined through the analysis of S(t) obtained from slices taken at different excitation frequencies of the 2DES spectra. The extracted ultrafast timescales range from 36 to 98 fs, and we interpret the frequency dependence of the timescales in the context of other dynamic processes that also lead to lineshape changes in the 2DES spectrum, such as vibrational energy relaxation and spectral diffusion. Through comparison of the extracted timescales, we find that the fastest timescales are extracted over a range of excitation frequencies, where contributions from vibrational relaxation and spectral diffusion can be minimized.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2020

Electrochemical Li Intercalation in Black Phosphorus: In Situ and Ex Situ Studies

A systematic study on electrochemical charge transfer in Li-doped black phosphorous (BP) was carried out by both in-situ and ex-situ Raman scattering. Galvanostatic discharge of dedicated in-situ electrochemical cell for Raman spectroscopy was used to study time evolution of vibrational modes under lithiation. In addition to the peak broadening which is a result of structural expansion, peaks corresponding to all three atomic vibrational modes A 1 g , B 2 g and A 2 g were found to red-shift as a result of lithiation. Peaks B 2 g and A 2 g were shifted about 1.6 times more towards lower wavenumbers in comparison to A 1 g . Further characterizations using optical and electron microscopy showed that the intercalation of BP is highly anisotropic, where channels along the zigzag direction were found to be the easy direction for intercalation. X-ray diffraction on intercalated samples confirmed a reduction of thickness as lithiation weakens interlayer bonding, thus resulting in a partial exfoliation of BP flakes. Here, first principle studies using density function theory (DFT) were used to develop a theoretical model for the intercalation mechanism. The discrepancy between the experimental and the theoretical results was also addressed.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2025

Single-Atom-Resolved Vibrational Spectroscopy of a Dislocation

Dislocations in III-nitride semiconductors impede heat transport, leading to localized overheating, which severely limits the performance and reliability of optoelectronic and power devices. Current research on phonon–dislocation interactions primarily addresses bulk materials, focusing on the average effects at specific dislocation densities. However, phonon resistance from dislocation scattering arises from both short-range core interactions and long-range strain field interactions, which remain largely unexplored. Here, in this study, electron energy-loss spectroscopy is used to investigate a GaN dislocation. Vibrational modes localized on specific core atoms are revealed, reflecting short-range interactions. Additionally, phonon energy shifts driven by strain fields surrounding the dislocation are observed, reflecting long-range interactions. Ab initio calculations support these findings and draw out additional details. This work establishes a paradigm for probing defect-induced phonon scattering at the single-atom level, revealing how dislocations affect phonon behavior through atomic reconstruction and strain engineering, thus offering insights for designing improved material functionalities.

III-nitride semiconductors↗

DOE OSTI2011

Effect of electron flow on the ordinary-extraordinary mode conversion

Ordinary-extraordinary mode conversion in the electron cyclotron frequency range is revisited in the presence of a flowing electron component. The analytical expressions of optimal parallel refraction index and conversion efficiency are obtained from a one-dimensional cold plasma model. The presence of flowing electrons leads to an outward shift of the conversion layer and therefore increases the optimal value of parallel refraction index. If this effect is not considered, the efficiency of mode conversion degenerates. In typical tokamak plasmas, this degeneration is about a few percentages, which may induce the reflection of several tens of kilowatts of power from the cutoff layer when injecting megawatts of ECRF power into fusion plasma.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2015

Composition-dependent structural and Raman spectroscopic studies on Y{sub 1-x}Ho{sub x}CrO{sub 3} (0≤x≤0.1)

In this paper we report the synthesis and structural characterization of polycrystalline holmium doped YCrO{sub 3} samples prepared by solid state reaction method. X-ray diffraction studies confirm the formation of single phase pure materials. Increasing Holmium substitution in Y{sub 1-x}Ho{sub x}CrO{sub 3} (0≤x≤0.1) allows a quasi-continuous tuning of the lattice in this multiferroic chromite without any magnetic interference effects of rare-earth ions. The composition dependent Raman scattering studies at room temperature reveal decreasing Raman mode frequencies with increasing holmium content consistent with the X-ray data. Decreasing phonon frequency shifts with increasing holmium content occurs, depending on the average rare-earth ion radius determined by the concentration of Y{sup +3} and Ho{sup +3}.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DOE OSTI2015

The manifestation of spin-phonon coupling in CaMnO{sub 3}

Recently predicted presence of spin-phonon coupling in the CaMnO{sub 3} is experimentally confirmed in infrared (IR), Raman and time-domain THz spectra. Most of phonon frequencies seen below 350 cm{sup −1} exhibit significant shifts on cooling below antiferromagnetic phase transition at T{sub N} ≅ 120 K. Moreover, several new modes activate in the IR and Raman spectra on cooling below T{sub N}. Sum of phonon contributions to static permittivity exhibits small but reliable anomaly at T{sub N}. On the other hand, the spin-phonon coupling is not manifested in temperature dependence of radio-frequency permittivity, because intrinsic permittivity is screened by extrinsic contribution from conductivity, which enhances the permittivity to giant values.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2016

Mach-Zehnder interferometric photonic crystal fiber for low acoustic frequency detections

Low frequency under-water acoustic signal detections are challenging, especially for marine applications. A Mach-Zehnder interferometric hydrophone is demonstrated using polarization-maintaining photonic-crystal-fiber (PM-PCF), spliced between two single-mode-fibers, operated at 1550 nm source. These data are compared with standard hydrophone, single-mode and multimode fiber. The PM-PCF sensor shows the highest response with a power shift (2.32 dBm) and a wavelength shift (392.8 pm) at 200 Hz. High birefringence values and the effect of the imparted acoustic pressure on this fiber, introducing the difference between the fast and slow axis changes, owing to the phase change in the propagation waves, demonstrate the strain-optic properties of the sensor.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2020

A microchip microcontroller-based transducer controller for non-contact scanning probe microscopy with phase-locked loop, amplitude, and Q control

An inexpensive yet versatile transducer controller for non-contact scanning probe microscopy (SPM) based on a PIC32 microcontroller from Microchip Technology, Inc is described. In addition to feedback control using the amplitude or phase of the signal from the non-contact transducer, the controller includes a phase-locked loop for frequency-shift feedback, as well as fixed-amplitude, quality factor (Q) control, and self-excitation modes. Apart from the input amplifiers, output buffers, and the Q-control circuit, all other functions of the controller are instantiated in software on the microchip, enabling rapid changes in operating parameters if needed. The controller communicates with a host personal computer via a simple serial connection. The controller has been tested with a quartz tuning-fork transducer but can be used with any oscillating non-contact transducer.

47 OTHER INSTRUMENTATION↗

DOE OSTI2026

Isolating solvent–solute hydrogen bonding interactions via 2D IR solvation shell spectroscopy

The solvation shell around a solute is a fundamental feature of liquid-phase solutions, determining the behavior and properties of both the solute and the overall solution. Direct experimental measurements of the solvation shell properties are challenging due to the strong signals generated from the bulk solvent, which overwhelm the small contribution of the solvation shell. Here, we use ultrafast two dimensional infrared (2D IR) spectroscopy and intermolecular cross-peaks to isolate the IR absorption spectrum of methanol molecules in the solvation shell surrounding the solute N-methylacetamide. We demonstrate that the intermolecular coupling between the solvent and solute vibrations is indirectly mediated by a low-frequency hydrogen-bonding mode, suggesting an important mechanism for anharmonic coupling induced by hydrogen bonds. From the relative frequency shifts and cross-peak anisotropy, we find that methanol molecules surrounding N-methylacetamide form stronger and distinctly oriented hydrogen bonds than those in the bulk solvent. Here, we also compare these results with the solvent spectra of the solute N,N-dimethylacetamide to investigate how solute structural changes alter the solvation shell and the contribution of N–H hydrogen bond donation. Our results are supported by molecular dynamics simulations, which provide detailed insights into the hydrogen-bonding distributions. Through these results, we demonstrate 2D solvation shell spectroscopy to be a valuable method for investigating solvation structures and dynamics without interference from the bulk solvent.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2015

Inflation with massive vector fields

We investigate the coupling between the inflaton and massive vector fields. All renormalizable couplings with shift symmetry of the inflaton are considered. The massive vector can be decomposed into a scalar mode and a divergence-free vector mode. We show that the former naturally interacts with the inflaton and the latter decouples at tree level. The model in general predicts f{sub NL}equil = O(1), while in some regions of the parameter space large non-Gaussianity can arise.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2011

Light emission of a scarlike mode with assistance of quasiperiodicity

In an elliptic In{sub x}Ga{sub 1-x}AsP microcavity laser, various scarlike modes are experimentally observed. Below the lasing threshold, a bouncing-ball, a triangle, a double, and a triple bow-tie mode spontaneously emit. Above the threshold, a bow-tie scarlike mode lases alone. Our numerical analysis reveals that the bow-tie scarlike mode is not caused by regular islands in phase space due to the Goos-Haenchen shift, but by unstable periodic orbits and that the light emission is assisted by a quasiperiodic orbit.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2024

Multi-GeV wakefield acceleration in a plasma-modulated plasma accelerator

We investigate the accelerator stage of a plasma-modulated plasma accelerator (P-MoPA) [Jakobsson , ] using both the paraxial wave equation and particle-in-cell (PIC) simulations. We show that adjusting the laser and plasma parameters of the modulator stage of a P-MoPA allows the temporal profile of pulses within the pulse train to be controlled, which in turn allows the wake amplitude in the accelerator stage to be as much as 72 % larger than that generated by a plasma beat-wave accelerator with the same total drive laser energy. Our analysis shows that Rosenbluth-Liu detuning is unimportant in a P-MoPA if the number of pulses in the train is less than ∼ 30 , and that this detuning is also partially counteracted by increased red-shifting, and hence increased pulse spacing, towards the back of the train. An analysis of transverse mode oscillations of the driving pulse train is found to be in good agreement with 2D (Cartesian) PIC simulations. PIC simulations demonstrating energy gains of ∼ 1.5 GeV ( ∼ 2.5 GeV ) for drive pulse energies of 2.4 J ( 5.0 J ) are presented. Our results suggest that P-MoPAs driven by few-joule, picosecond pulses, such as those provided by high-repetition-rate thin-disk lasers, could accelerate electron bunches to multi-GeV energies at pulse repetition rates in the kilohertz range. Published by the American Physical Society 2024

van de Wetering, J. J. (ORCID:0000000303292355)↗

DOE OSTI2020

Theory of the tertiary instability and the Dimits shift within a scalar model

The Dimits shift is the shift between the threshold of the drift-wave primary instability and the actual onset of turbulent transport in magnetized plasma. It is generally attributed to the suppression of turbulence by zonal flows, but developing a more detailed understanding calls for consideration of specific reduced models. The modified Terry--Horton system has been proposed by St-Onge [J. Plasma Phys. {\bf 83}, 905830504 (2017)] as a minimal model capturing the Dimits shift. Here, we use this model to develop an analytic theory of the Dimits shift and a related theory of the tertiary instability of zonal flows. We show that tertiary modes are localized near extrema of the zonal velocity $U(x)$, where $x$ is the radial coordinate. By approximating $U(x)$ with a parabola, we derive the tertiary-instability growth rate using two different methods and show that the tertiary instability is essentially the primary drift-wave instability modified by the local $U''$. Then, depending on $U''$, the tertiary instability can be suppressed or unleashed. The former corresponds to the case when zonal flows are strong enough to suppress turbulence (Dimits regime), while the latter corresponds to the case when zonal flows are unstable and turbulence develops. This understanding is different from the traditional paradigm that turbulence is controlled by the flow shear $U'$. Our analytic predictions are in agreement with direct numerical simulations of the modified Terry--Horton system.

fusion plasmas↗