Effective field theory for fractional quantum Hall systems near ν = 5 / 2
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Hsin, Po-Shen (ORCID:0000000247641476)↗
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Results for “quantum effects”
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Role of the third dimension in searching for Majorana fermions in α-RuCl 3 via phonons
Understanding phonons in α-RuCl 3 is critical to analyze the controversy around the observation of the half-integer thermal quantum Hall effect. While many studies have focused on the magnetic excitations in α-RuCl 3 , its vibrational excitation spectrum has remained relatively unexplored. We investigate the phonon structure of α-RuCl 3 via inelastic neutron-scattering experiments and density-functional-theory calculations. Our results show excellent agreement between experiment and first-principles calculations. After validating our theoretical model, we extrapolate the low-energy phonon properties. We find that the phonons in α-RuCl 3 that either propagate or vibrate in the out-of-plane direction have significantly reduced velocities and therefore have the potential to dominate the observability of the elusive half-integer plateaus in the thermal Hall conductance. In addition, we use low-energy interlayer phonons to resolve the low-temperature stacking structure of our large crystal of α-RuCl 3 , which we find to be consistent with that of the R$\bar{3}$ space group, in agreement with neutron diffraction.
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
Weak localization and universal conductance fluctuations in large-area twisted bilayer graphene
We study diffusive magnetotransport in highly 𝑝-doped large-area twisted bilayer graphene in 1∘, 7∘, 9∘, and 20∘ samples. All samples exhibit weak localization, from which we extract the phase coherence length and intervalley scattering lengths, and from that determine that dephasing is caused by electron-electron scattering and intervalley scattering is caused by point defects. We observe signatures of universal conductance fluctuations in the 9∘ sample, which has high mobility and is near the van Hove singularity. Further improvements in sample quality and applications to large-area moiré materials will open new avenues to observe quantum interference effects.
Talkington, Spenser [University of Pennsylvania]↗
Thermodynamics and kinetics of H adsorption and intercalation for graphene on 6 H -SiC(0001) from first-principles calculations
Previous experimental observations for H intercalation under graphene on SiC surfaces motivate the clarification of configuration stabilities and kinetic processes related to intercalation. From first-principles density-functional-theory calculations, we analyze H adsorption and intercalation for graphene on a 6H-SiC(0001) surface, where the system includes two single-atom-thick graphene layers: the top-layer graphene (TLG) and the underling buffer-layer graphene (BLG) above the terminal Si layer. Our chemical potential analysis shows that in the low-H coverage regime (described by a single H atom within a sufficiently large supercell), intercalation into the gallery between TLG and BLG or into the gallery underneath BLG is more favorable thermodynamically than adsorption on top of TLG. However, intercalation into the gallery between TLG and BLG is most favorable. We obtain energy barriers of about 1.3 and 2.3 eV for a H atom diffusing on and under TLG, respectively. From an additional analysis of the energy landscape in the vicinity of a step on the TLG, we assess how readily one guest H atom on the TLG terrace can directly penetrate the TLG into the gallery between TLG and BLG versus crossing a TLG step to access the gallery. Finally, we also perform density functional theory calculations for higher H coverages revealing a shift in favorability to intercalation of H underneath BLG and characterizing the variation with H coverage in interlayer spacings.
36 MATERIALS SCIENCE↗
Swap motion–directed twinning of nanocrystals
Twinning frequently occurs in nanocrystals during various thermal, chemical, or mechanical processes. However, the nucleation and propagation mechanisms of twinning in nanocrystals remain poorly understood. Through in situ atomic resolution transmission electron microscopy observation at millisecond temporal resolution, we show the twinning in Pb individual nanocrystals via a double-layer swap motion where two adjacent atomic layers shift relative to one another. The swap motion results in twin nucleation, and it also serves as a basic unit of movement for twin propagation. Our calculations reveal that the swap motion is a phonon eigenmode of the face-centered cubic crystal structure of Pb, and it is enhanced by the quantum size effect of nanocrystals.
36 MATERIALS SCIENCE↗
Artificial intelligence “sees” split electrons
Chemical bonds between atoms are stabilized by the exchange-correlation (xc) energy, a quantum-mechanical effect in which “social distancing” by electrons lowers their electrostatic repulsion energy. Kohn-Sham density functional theory (DFT) states that the electron density determines this xc energy, but the density functional must be approximated. Furthermore, this is usually done by satisfying exact constraints of the exact functional (making the approximation predictive), by fitting to data (making it interpolative), or both. Two exact constraints—the ensemble-based piecewise linear variation of the total energy with respect to fractional electron number and fractional electron z-component of spin —require hard-to-control nonlocality. On page 1385 of this issue, Kirkpatrick et al. have taken a big step toward more accurate predictions for chemistry through the machine learning of molecular data plus the fractional charge and spin constraints, expressed as data that a machine can learn.
74 ATOMIC AND MOLECULAR PHYSICS↗
Transition energy measurements of the X-ray lines of neon-like europium
Here, we report the measurements of the n = 3 → n = 2 L-shell X-ray transitions of neon-like Eu 53+ . These include all seven allowed electric dipole (E1) transitions, five electric quadrupole (E2) transitions, and one magnetic quadrupole (M2) transition. The measurements were carried out at the EBIT-I electron beam ion trap facility at Livermore using an X-ray calorimeter. The measured values agree with many-body perturbation theory calculations within the experimental uncertainties. This includes the transitions that involve a 2s electron and that are, therefore, strongly affected by quantum electrodynamical effects.
74 ATOMIC AND MOLECULAR PHYSICS↗
Electron dynamics in extended systems within real-time time-dependent density-functional theory
Due to a beneficial balance of computational cost and accuracy, real-time time-dependent density-functional theory has emerged as a promising first-principles framework to describe electron real-time dynamics. Here we discuss recent implementations around this approach, in particular in the context of complex, extended systems. Results include an analysis of the computational cost associated with numerical propagation and when using absorbing boundary conditions. Here we extensively explore the shortcomings for describing electron–electron scattering in real time and compare to many-body perturbation theory. Modern improvements of the description of exchange and correlation are reviewed. In this work, we specifically focus on the Qb@ll code, which we have mainly used for these types of simulations over the last years, and we conclude by pointing to further progress needed going forward.
2D materials↗
HPC4Mfg with Samsung: Making semiconductor devices cool through HPC ab initio simulations
For decades, the semiconductor technology has followed the Moore’s law, making newer devices more powerful and energy efficient. Recently, however, it has reached a point where the performance and the energy efficiency of the device do not improve with the shrinking device size. One of the fundamental reasons of this deviation from the past trend is the interconnect resistance, which becomes larger with the shrinking size. The devices size is so small that the quantum mechanical effects can no longer be ignored and the traditional continuum simulation tools such as TCAD become inadequate. In this project, Samsung Semiconductor Inc. and Lawrence Berkeley National Laboratory has collaborated to perform first of kind device-scale ab initio simulations to optimize materials and interconnect morphology to minimize interconnect resistance. We have tested the use of LS3DF method and the PEtot_trans approach on top of the folded spectrum method (FSM) Escan code to calculate the scattering state, and to study various effects influence the interconnect conductivity. We found that, the LS3DF can be used to calculate such metallic system. On the other hand, the use of Escan code to solve the linear equation is not practical due to the slow convergence. We have implemented a Chebyshev filter technique to calculate a few hundred eigen states near the scattering state energy E, then use these eigen states as preconditioner to solve the linear equation. We have used this approach to study the different factors which affect the interconnect conductivity, including the shape, the point defect, the temperature, and the grain boundary.
32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
(U) Segmented Scintillator Pitch, Thickness, and Septa Material Effects on the Swank Factor, Quantum Efficiency, and DQE(0) for High-Energy X-Ray Radiography
Scintillator design is an important aspect in constructing a radiographic facility in order to collect the most robust data possible. For the proposed Enhanced Capabilities for Sub-critical Experiment (ECSE) facility in Nevada, we explored a permutation of 13 segmented scintillator designs in order to understand the best performance and trade offs for each design. We calculated the quantum efficiency, Swank factor, and detective quantum efficiency at zero-frequency (DQE(0)) for each scintillator design in order to compare performance.
46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
Ruling out Color Transparency in quasi-elastic 12C(e,e′p) up to Q2=14 (GeV/c)2*
Color transparency (CT) is a fundamental phenomenon of QCD postulating that at high momentum transfer, one can preferentially measure hadrons that fluctuate to a small color neutral transverse size in the nucleus, and final state interactions within the nuclear medium are suppressed. This talk will discuss the recent quasi-elastic 12C(?,???) scattering measurement in Hall C at momentum transfer squared ?2=8,9.4,11.4, and 14.2 (GeV/c)2, the highest ever achieved to date. Nuclear transparency for this reaction was extracted by comparing the measured yield to that expected from a plane-wave impulse approximation calculation without any final state interactions. The measured transparency was observed to be independent of ?2, ruling out the quantum chromodynamics effect of color transparency at such momentum scales. These new results impose strict constraints on models of color transparency for protons.
Szumila-Vance, Holly↗
Quantum Transport in 2D Semiconductors
Leveraging progress in synthesis of ultra-pure transition metal dichalcogenide (TMD) crystals, our team has made key breakthroughs in the study of quantum states in two-dimensional (2D) TMD semiconductors. Using a capacitance spectroscopy technique, we have observed the first signatures of fractional quantum Hall states in monolayer WSe 2 and clear signatures of interlayer exciton condensates in bilayer WSe 2 . In a transport study of bilayer WSe 2 , we report observation of spin-selective magneto-conductivity in WSe 2 . To improve electrical transport studies, we have focused on metal-TMD contacts by studying the behavior of metal-TMD contacts in the clean limit, and developing a new contact doping technique that achieves Ohmic contact down to low temperature and low carrier density. Using this new technique, we study electrical transport in monolayer WSe 2 down to low temperature and low carrier density, finding record-high hole mobility and evidence of a metal-insulator transition at low density. Under high magnetic fields, we observe clear signatures of fractional quantum Hall effect in transport for the first time in a TMD.
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
Study of the Neutrino Magnetic Moment with the NOvA Near Detector
Predicted by the Standard Model as theoretical, massless particles, neutrinos have been the subject of many experiments since their first detection. It is now experimentally confirmed that neutrinos do have mass necessitating an extension to the Standard Model. Such an extension allows for other surprising neutrino properties, such as a neutrino magnetic moment. While neutrinos are observed to be neutral and do not couple to photons at leading order, higher order expansion of the interaction allows for coupling to the photon to occur and gives rise to a neutrino magnetic moment through quantum loop effects. This is a useful property for studying the Dirac or Majorana nature of neutrinos, as the predicted value of the magnetic moment would differ. This talk focuses on an introduction to the neutrino magnetic moment as well as discusses the current status of work being done on NOvA utilizing the Near Detector to obtain an upper limit on the neutrino magnetic moment value.
43 PARTICLE ACCELERATORS↗
Microwave and rf Spectroscopy of 2D Carrier Systems and Bilayers (Final Technical Report)
We performed microwave spectroscopic studies of two dimensional electron systems (2DES) exhibiting the quantum Hall effect (QHE) in GaAs/Al${_x}$Ga$_{1-x}$As heterostructures. A common theme of the proposed work is electron solids, of which the simplest is the Wigner crystal, a triangular lattice of individual carriers. The solids are stabilized by carrier-carrier interaction and occur under conditions when the kinetic energy of the system is "frozen out" by high magnetic field, $B$. One of the main reasons for microwave spectroscopic study of 2DES is that the solid phases have striking microwave or rf spectra. In the low wave vector ($q$) limit these spectra exhibit a resonance that is understood as a pinning mode, a small collective oscillation of pieces of the solid within the disorder potential. Pinning modes can be very sharp, with quality factors up to around 30, and are valuable as signatures of the electron solids, and can reveal a solid even when standard dc transport shows an insulator, an integer QHE, or even a fractional QHE The pinning mode also is sensitive to the solid properties, and can reveal transitions between solids.
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
Radiation Response of Low Dimensional Carbon Systems
The project is aimed at understanding the fundamentals of radiation response of low dimensional carbon systems and irradiation-induced mechanical property changes, with a focus on the unique phenomena caused by their geometry, boundary, and quantum size effects. In comparison with their bulk counterparts (graphite), radiation responses of low-dimensional carbon systems are substantially different. The differences exist at almost every stage of defect development, namely, displacement creation, damage cascade, thermal spike formation defect recombination, defect clustering, and structural reconstruction. Many traditional concepts in ion-solid interaction theory do not apply at the nanoscale or require substantial modification. Through this project, we systematically studied various aspects of radiation damage development in graphene, carbon nanotubes (CNTs), and graphite.
36 MATERIALS SCIENCE↗
Decay spectroscopy of an isomeric state in 251 Md
Superheavy elements ( Z ≥ 104) owe their existence to quantum shell effects which stabilize them against fission. Experimental studies of their structure are challenging, and only recently has direct information begun to emerge. Meanwhile, the comparative ease of producing the transfermium nuclei offers an alternative approach. These nuclei are well-deformed ( β 2 ≈ 0.28) owing to the existence of deformed gaps in the single particle spectrum near Z = 100 and N = 152. Because of this, the proton orbitals near the Fermi surface in this region are expected to originate from the spherical sub shells which define the shell gaps near Z = 114. In this sense, the transfermium nuclei act as a testing ground for theoretical models used to describe the superheavy region. Deformed odd-mass nuclei are of particular interest since they can provide direct insight into the single particle structure.
73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
Topological Model of the Pseudogap State: Experimental Signatures
We summarize the basic ideas of our topological model of the pseudogap state of high temperature superconductors (HTS) as a condensate of charged magnetic monopoles, with a focus on new experimental signatures. These include the surface quantum Hall effect, the generation of electric fields when applying magnetic fields by the oblique Meissner effect, and the generation of circular electric fields surrounding electric currents by the oblique Ampère law.
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
Bottomonium suppression in pNRQCD and open quantum system approach
By employing the potential non-relativistic quantum chromodynamics (pNRQCD) effective field theory within an open quantum system framework, we derive a Lindblad equation governing the evolution of the heavy-quarkonium reduced density matrix, accurate to next-to-leading order (NLO) in the ratio of the state's binding energy to the medium's temperature [1]. The derived NLO Lindblad equation provides a more reliable description of heavy-quarkonium evolution in the quark-gluon plasma at low temperatures compared to the leading-order truncation. For phenomenological applications, we numerically solve this equation using the quantum trajectories algorithm. By averaging over Monte Carlo-sampled quantum jumps, we obtain solutions without truncation in the angular momentum quantum number of the considered states. Our analysis highlights the importance of quantum jumps in the nonequilibrium evolution of bottomonium states within the quark-gluon plasma [2]. Additionally, we demonstrate that the quantum regeneration of singlet states from octet configurations is essential to explain experimental observations of bottomonium suppression. The heavy-quarkonium transport coefficients used in our study align with recent lattice QCD determinations.
72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗