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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 127 records · Page 7

Coherent band-edge oscillations and dynamic longitudinal-optical phonon mode splitting as evidence for polarons in perovskites

The coherence of collective modes, such as phonons and polarons, and their modulation of electronic states is long sought in complex systems, which is a crosscutting issue in photovoltaics and quantum electronics. In photovoltaic cells and lasers based on metal halide perovskites, the presence of polarons, i.e., photocarriers dressed by the macroscopic motion of charged lattice, assisted by terahertz (THz) longitudinal-optical (LO) phonons, has been intensely studied yet is still debated. This may be key for explaining the remarkable properties of the perovskite materials, e.g., defect tolerance, long charge lifetimes, and diffusion lengths. In this work we use the intense single-cycle THz pulse with peak electric field up to E THz = 1000 kV/cm to drive coherent polaronic band-edge oscillations at room temperature in CH 3 NH 3 PbI 3 (MAPbI 3 ). We reveal the oscillatory behavior is dominated by a specific quantized lattice vibration mode at $ω$ LO ~ 4 THz, which is both dipole and momentum forbidden. THz-driven coherent polaron dynamics exhibits distinguishing features: room temperature coherent oscillations at ω LO longer than 1 ps in both single crystals and thin films, mode-selective modulation of different band-edge states assisted by electron-phonon interaction, and dynamic mode splitting at low temperature due to entropy and anharmonicity of organic cations. Our results demonstrate intense THz-driven coherent band-edge modulation is a powerful probe of electron-lattice coupling phenomena and polaronic quantum control in perovskites.

36 MATERIALS SCIENCE↗

Distributed Fiber Optic Arrays: Integrated Temperature and Seismic Sensing for Detection of CO 2 Flow, Leakage and Subsurface Distribution (Final Report)

This report describes the seismic and heat-pulse monitoring equipment, surveys, results and accomplishments of the fiber optic (FO) project funded by the U.S. Department of Energy (DOE) under Agreement Number DE-FE0012700. The formal title of the project is “Distributed Fiber Optic Arrays: Integrated Temperature and Seismic Sensing for Detection of CO 2 Flow, Leakage and Subsurface Distribution.” The project focuses on the field acquisition of FO data using Distributed Acoustic Sensing (DAS) arrays for subsurface imaging of geologic structure and to track the CO 2 migration in the injection interval using time-lapse techniques. A second component of the project uses a novel heat-pulse monitoring method that relies on Distributed Temperature Sensing (DTS) to evaluate near-field leakage of CO 2 or brine in and around the wellbore. The Southeast Regional Carbon Sequestration (SECARB) partnership hosted the project at the Anthropogenic Test site near Citronelle, Alabama after the original site host, the Kansas Geological Survey (KGS), experienced significant delays in permitting its CO 2 injection well at the Wellington Oil Field site in Kansas. The KGS project was later terminated in 2017 before an injection permit issued. A second field trial was planned for the Livingston Oil Field, located in Louisiana, but the site host ran into financial troubles and the project was terminated in 2015. A replacement field-site host was not found for the Livingston field trial. Both the Wellington, Kansas and Livingston, Louisiana projects were funded by DOE. A novel sensor platform referred to as the Modular Borehole Monitoring (MBM) system deployed at the Citronelle field site was utilized by the FO project. Two different seismic sensor technologies were incorporated in the Citronelle MBM system design including: (1) a semi-permanent, tubing-deployed, 18-level geophone array with custom hydraulic clamps; and (2) two, single mode optical fibers for Distributed Acoustic Sensing (DAS). Incorporation of the 18-level geophone array in the MBM system provided an ideal opportunity to compare the DAS response to conventional geophones. A heat-pulse monitoring system consisting of two, multi-mode optical fibers for Distributed Temperature Sensing (DTS) and copper heater element were also incorporated into the MBM package. This report provides an overview of the design of the MBM, DAS, and DTS equipment and the surveys performed during the study. The heat-pulse monitoring technique was used to diagnose a completion problem with observation well D-9-8 #2 where the MBM system was installed in 2012, thus successfully demonstrating its application for leak detection. In 2015, CO 2 unexpectedly arrived at the observation well approximately one year after CO 2 injection and heat-pulse monitoring ended. It was determined at this time that saltwater intrusion had likely penetrated the stainless-steel capillary tube containing the fibers and copper heater elements, thus preventing the heater from being used. DTS measurements indicated that the fiber had also degraded probably due to hydrogen darkening. It is recommended that the capillary tube be constructed of a more corrosive resistant material (e.g., Inconel) in the future should it be deployed in similar harsh downhole environments. Geophysical imaging of the subsurface and monitoring of the CO 2 were successful using DAS in the vertical seismic profile (VSP) survey configuration. A high resolution VSP image of the subsurface was obtained in 2014 using DAS, which exceeded our expectations in comparison to a lower resolution image obtained by SECARB in 2012 using an 80-level geophone array. A time-lapse image of the redistribution of CO 2 after injection ended in September 2014 was obtained using two DAS VSP surveys from June 2014 and December 2015, thus successfully demonstrating its application. DAS data were also acquired during a crosswell seismic survey conducted in 2014. Unfortunately, the DAS technique was not success in the crosswell survey configuration because the noise level was too high, increasing by a factor of ten, over the high frequency output (100-1,200) of the piezoelectric source.

58 GEOSCIENCES↗

Optical Properties of Copper-Doped Lithium Niobate Crystals

We have studied the optical properties of copper-doped lithium niobate crystals using semiconductor light-emitting diodes and lasers emitting in the visible and ultraviolet spectral regions as excitation sources. The results demonstrate that, at an excitation frequency approaching the frequency of electronic absorption in copper ions, there is discrete resonance Raman scattering in the form of a frequency comb. The observed Raman satellites of discrete light scattering are due to polar longitudinal A{sub 1} optical modes of the lithium niobate single crystal. Under excitation by a light-emitting diode with a wavelength of 520 nm, we observe a sharp increase in discrete light scattering intensity in comparison with the photoluminescence excited by shorter wavelength excitation sources.

36 MATERIALS SCIENCE↗

Ultralow Thermal Conductivity in Diamond-Like Semiconductors: Selective Scattering of Phonons from Antisite Defects

In this work, we discover anomalously low lattice thermal conductivity (<0.25 W/mK at 300 degrees C) in the Hg-containing quaternary diamond-like semiconductors within the Cu2IIBIVTe4 (IIB: Zn, Cd, Hg) (IV: Si, Ge, Sn) set of compositions. Using high-temperature X-ray diffraction, resonant ultrasound spectroscopy, and transport properties, we uncover the critical role of the antisite defects HgCu and CuHg on phonon transport within the Hg-containing systems. Despite the differences in chemistry between Hg and Cu, the high concentration of these antisite defects emerges from the energetic proximity of the kesterite and stannite cation motifs. Our phonon calculations reveal that heavier group IIB elements not only introduce low-lying optical modes, but the subsequent antisite defects also possess unusually strong point defect phonon scattering power. The scattering strength stems from the fundamentally different vibrational modes supported by the constituent elements (e.g., Hg and Cu). Despite the significant impact on the thermal properties, antisite defects do not negatively impact the mobility (>50 cm2/(Vs) at 300 degrees C) in Hg-containing systems, leading to predicted zT > 1.5 in Cu2HgGeTe4 and Cu2HgSnTe4 under optimized doping. In addition to introducing a potentially new p-type thermoelectric material, this work provides (1) a strategy to use the proximity of phase transitions to increase point defect phonon scattering, and (2) a means to quantify the power of a given point defect through inexpensive phonon calculations.

14 SOLAR ENERGY↗

Optical guided modes coupled with Cerenkov radiation excited in Si slab using angular-resolved electron energy-loss spectrum

Retardation effects in the valence electron energy-loss spectrum (EELS) of a Si slab are analyzed by angular-resolved EELS. The dispersion curves of the valence spectra excited in a slab are directly observed from a specimen area with several different thicknesses and are interpreted by performing a calculation of the dispersion relation using Kroeger's formula. The dispersion curves observed below about 3 eV are attributed to guided modes coupled with Cerenkov radiation (CR). The coupling between guided modes and CR is found to be dependent on the sample thickness (t). For the sample with t > 150 nm, the intensity of the guided modes increased linearly with thickness, revealing the coupling with CR. For t < 150 nm, however, the intensity of the guided modes rapidly decreased due to a diminished coupling with CR, resulting from the thickness-dependent dispersion curves of the guided modes.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Optical phonon modes in rhombohedral boron monosulfide under high pressure

Raman spectra of rhombohedral boron monosulfide (r-BS) were measured under pressures up to 34 GPa at room temperature. No pressure-induced structural phase transition was observed, while strong pressure shift of Raman bands towards higher wavenumbers has been revealed. IR spectroscopy as a complementary technique has been used in order to completely describe the phonon modes of r-BS. All experimentally observed bands have been compared with theoretically calculated ones and modes assignment has been performed. r-BS enriched by {sup 10}B isotope was synthesized, and the effect of boron isotopic substitution on Raman spectra was observed and analyzed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Optimization of Stabilization Modes of Optical Frequency Standards Based on the Saturated Absorption Resonance

A theoretical study is carried out within the framework of density matrix formalism of the error signal slope for frequency standards based on the resonance of saturated absorption excited in the field of two counterwaves. Two schemes of error-signal formation are considered: in the first case, the frequency of only the test field is modulated, and, in the second case, the frequency modulation of both waves is carried out. On the basis of the calculations, the optimal parameters of harmonic modulation are determined, at which the slope has the maximum value.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

A Portable 16-channel Magnetic Sensor for Human Magnetocardiographic Experiments

Here, we constructed a portable, low-cost 16-channel magnetic sensor for magnetocardiography (MCG) applications. The sensor is based on a high-sensitivity optically pumped magnetometer (OPM) with a novel configuration of nearly parallel pump and probe laser beams. The OPM-based 16-channel magnetic sensing is realized in a single module by using a fairly large rubidium vapor cell, broad pump/probe laser beams, and a 16-channel photodiode array, leading projected 10-fold reduction of the cost of sensors. The portability of the sensor is achieved by coupling the pump and probe lasers to OPM optics through multi-mode optical fibers. The 16-channel magnetic sensor is surrounded by a non-magnetic enclosure for safe operation. For MCG experiments with the sensor, its main components except lasers are located inside a magnetically shielded room (MSR), which reduces the ambient magnetic noise. The location of lasers and supporting electronics outside the MSR improves the sensitivity of the sensor. We report that the 16-channel magnetic sensor has a magnetic field sensitivity sufficient to directly detect the human cardiac magnetic signals.

16-channel magnetic sensing↗

A ladder of polariton branches formed by coupling an organic semiconductor exciton to a series of closely spaced cavity-photon modes

We construct a microcavity in which the extended optical path length of the cavity (5.9 μm) permits a series of closely spaced optical modes to be supported. By placing a J-aggregated cyanine dye into the cavity, we reach the strong-coupling regime and evidence a simultaneous optical hybridization between the organic-exciton and a number of the confined cavity modes, forming an effective ladder of polariton branches. We explore the emission from such cavities and evidence a polariton-population on adjacent polariton branches around k{sub ∥} = 0.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗