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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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Te/CdTe and Al/CdTe Interfacial Energy Band Alignment by Atomistic Modeling
A synergistic approach that incorporates first-principles atomistic modeling with numerical device simulations is used to systematically evaluate the role of heterointerfaces within metal-chalcogenide-based photovoltaic technologies. Two interfaces involving either a tellurium back contact or aluminum back electrode combined with a cadmium telluride absorber layer within cadmium-telluride-based thin-film solar cells are investigated on an atomic scale to determine the mechanisms contributing to variations in device performance. Electronic structures and predicted charge transport behavior with respect to cadmium and tellurium termination of the absorber layer are studied along the polar oriented CdTe{111} facets. The computational methodology reveals a noticeable contrast between the Schottky barrier forming Al/CdTe interface versus the Type I Te/CdTe heterojunction. Greater band bending features are exhibited by the cadmium termination as opposed to the tellurium termination for each interface case. Subsequent device modeling suggests that 3.6% higher photovoltaic conversion efficiency is achievable for the cadmium termination relative to the tellurium termination of the Te/CdTe interface. Based strictly on an idealistic representation, both interface models show the importance of atomic-scale interfacial properties for cadmium telluride solar cell device performance with their bulk properties being validated in comparison to published experimental data. Here, the synergistic approach offers a suitable method to analyze solar cell interfaces through a predictive computational framework for the engineering and optimization of metal-chalcogenide-based thin-film photovoltaic technologies.
Energy Level Alignment and Morphology of Ag and Au Nanoparticle Recombination Contacts in Tandem Planar Heterojunction Solar Cells
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Suppression of target patterns in domain aligned cold-zone annealed block copolymer films with immobilized film-spanning nanoparticles
N/A
Ultrafast laser orthogonal alignment and patterning of carbon nanotube-polymer composite films
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Influence of Sb incorporation on InGaAs(Sb)N/GaAs band alignment
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Band alignment in visible-light photo-active CoO/SrTiO3 (001) heterostructures
Not Available
The contribution of radio-frequency rectification to field-aligned losses of high-harmonic fast wave power to the divertor in the National Spherical Torus eXperiment
The National Spherical Torus eXperiment (NSTX) can exhibit a major loss of high-harmonic fast wave (HHFW) power along scrape-off layer (SOL) field lines passing in front of the antenna, resulting in bright and hot spirals on both the upper and lower divertor regions. One possible mechanism for this loss is RF sheaths forming at the divertors. Here, we demonstrate that swept-voltage Langmuir probe characteristics for probes under the spiral are shifted relative to those not under the spiral in a manner consistent with RF rectification. We estimate both the magnitude of the RF voltage across the sheath and the sheath heat flux transmission coefficient in the presence of the RF field. Although precise comparison between the computed heat flux and infrared (IR) thermography cannot yet be made, the computed heat deposition compares favorably with the projections from IR camera measurements. The RF sheath losses are significant and contribute substantially to the total SOL losses of HHFW power to the divertor for the cases studied. This work will guide future experimentation on NSTX-U, where a wide-angle IR camera and a dedicated set of coaxial Langmuir probes for measuring the RF sheath voltage directly will quantify the contribution of RF sheath rectification to the heat deposition from the SOL to the divertor.
Electrochemical tuning of vertically aligned MoS2 nanofilms and its application in improving hydrogen evolution reaction
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Theoretical investigation of the band alignment of graphene on a polar SrTi O 3 (111) surface
Not Available
Rotation-Aligned Isomer and Oblate Collectivity in {sup 196}Pt
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Avoiding Tokamak Disruptions by Applying Static Magnetic Fields That Align Locked Modes with Stabilizing Wave-Driven Currents [Avoiding Tokamak Disruptions by Magnetically Aligning Locked Modes with Stabilizing Wave-Driven Currents]
The international ITER tokamak has the objective of demonstrating the scientific feasibility of magnetic confinement fusion as a source of energy. A concern towards the achievement of this goal is represented by major disruptions: complete losses of confinement often initiated by a non-rotating ('locked') magnetic island created by magnetic reconnection. During disruptions, energy and particles accumulated in the plasma volume over many seconds are lost in a few milliseconds and released on the plasma-facing materials. In addition, multi-MA level currents flowing in the tokamak plasma for its sustainment and confinement are lost, also in milliseconds, thus terminating the plasma discharge and causing electromagnetic stresses that, if unmitigated, could lead to excessive device wear. Moreover it is shown that magnetic perturbations can be used to avoid disruptions by "guiding" the magnetic island to lock in a position where it is accessible to millimetre wave beams that fully stabilize it.
Interface Structure, Band Alignment, and Built-In Potentials at LaFeO 3 / n - SrTiO 3 Heterojunctions
We demonstrate that LaFeO 3 /n-SrTiO 3 (001) heterojunctions engineered to have opposite interface polarities exhibit very similar band offsets and built-in potentials within the LaFeO 3 layer of the same sign. However, heterojunctions with the TiO20-LaO+ interface structure attract electronic charge from the n-STO substrate, whereas those with the SrO0-FeO2-1 interface structure do not. These results suggest that the latter would more effectively facilitate photogenerated electron-hole pair separation than the former, an important result for photoelectrochemical water splitting
Fiducial marker application method for position alignment of in situ multimodal X-ray experiments and reconstructions
An evolving suite of X-ray characterization methods are presently available to the materials community, providing a great opportunity to gain new insight into material behavior and provide critical validation data for materials models. Two critical and related issues are sample repositioning during an in situ experiment and registration of multiple data sets after the experiment. To address these issues, a method is described which utilizes a focused ion-beam scanning electron microscope equipped with a micromanipulator to apply gold fiducial markers to samples for X-ray measurements. The method is demonstrated with a synchrotron X-ray experiment involving in situ loading of a titanium alloy tensile specimen.
Controller Design for Two-Input Single-Output Systems Exploiting Plant/Controller Alignment.
Abstract not provided.