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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 235 records · Page 13
All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

Observation of Coulomb blockade and Coulomb staircases in superconducting Pr 0.8 Sr 0.2 NiO 2 films

Motivated by the discovery of superconductivity in the infinite-layer nickelate family, we report an experimental endeavor to clean the surface of nickelate superconductor Pr 0.8 Sr 0.2 NiO 2 films by Ar + ion sputtering and subsequent annealing, and we study their electronic structures by cryogenic scanning tunneling microscopy and spectroscopy. The annealed surfaces are characterized by nano-sized clusters and Coulomb staircases with periodicity inversely proportional to the projected area of the nanoclusters, consistent with a double-barrier tunneling junction model. Moreover, the dynamical Coulomb blockade effects are observed and result in well-defined energy gaps around the Fermi level, which correlate closely with the specific configuration of the junctions. These Coulomb blockade-related phenomena provide an alternative plausible cause of the observed gap structure that should be considered in the spectroscopic understanding of nickelate superconductors with the nano-clustered surface.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

Magnetism dynamics driven by phase separation in Pr-doped manganite thin films: A ferromagnetic resonance study

In this work, we performed ferromagnetic resonance measurements of a (La 1–x Pr x ) 1–y Ca y MnO 3–δ with x = 0.52 ± 0.05, y = 0.23 ± 0.04, and δ = 0.14 ± 0.10 thin single crystalline film which, in combination with micromagnetic simulations, reveal three temperature regions consistent with (i) a ferromagnetic-paramagnetic transition in which ferromagnetic domains nucleate and grow, (ii) followed by a filamentary fluidlike percolation of magnetic domains exhibiting dynamic processes and finally, iii) the existence of a blocking temperature below which the magnetism is a metastable glassy-like state with strong decoherence of the uniform resonance mode. Our results suggest a strain-liquid to strain-glass spin order transition in which the magnetism and fluidlike dynamics of the separated phases freeze at low temperatures. We show the magnetism dynamics depend strongly on the phase-separated state and morphology of the magnetic domains suggesting a route to control of phase separation and realization of spintronic and magnonic devices.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Theoretical Correlation of Elemental Distribution of Nd and Pr in Ce-Fe-B Microstructure With Hard Magnetic Properties

Relatively resource-rich but property inferior-Ce-Fe-B magnet can be improved by partial replacement of Ce by Nd and/or Pr. In addition to the amount of Nd/Pr, their distribution profile in microstructure plays an important role. From our first principles density functional theory (DFT) calculation, the substitution energy of Ce by Pr/Nd is negative in Ce 2 Fe 14 B (2:14:1) while that for laves phase, CeFe 2 is positive, implying that Nd/Pr stabilize 2:14:1 and suppress the formation of the CeFe 2 phase. Further, micromagnetic simulation indicates that homogenized distribution of Nd/Pr improves squareness of demagnetization curve, while core (Ce-rich)-shell (Nd/Pr-rich) 2:14:1 grain structure enhances coercivity. Magnetic properties of Ce-Fe-B can be optimized by manipulating distribution profile of chemical element in microstructure based on their subtle difference in thermodynamic property, which is an effective pathway to design optimized chemical composition and processing route for high-performance magnet.

36 MATERIALS SCIENCE↗
DOE OSTI2021

An Investigation of the Effects of Volume Fraction on Drag Coefficient of Non-Spherical Particles Using PR-DNS

Prediction of the drag coefficient is required in gas-particle multiphase flow modeling and simulation. Experimental data and correlations on the fixed-bed system of spherical particles with high volume fractions for various possible arrangements are available in the literature. However, the effect of volume fraction on the drag coefficient of non-spherical particles is not well studied. In solving the momentum equation, the volume fraction plays a vital role in determining the flow resistances. In this paper, we study the impact of volume fraction in the range of 0.069 to 0.65 on the drag coefficient using the computational fluid dynamics (CFD) simulation of air for Reynold number in the range of 10 to 10000 using particle resolved direct numerical solution (PR-DNS). Regular non-spherical particles such as a cube, tetrahedron, and spheroids are used in this study since their single particle’s drag coefficient data are available in the literature for comparison. For this work, the simulations are carried out in the Ansys Fluent using polyhedral mesh, which consumes significantly less computational time and power. The study showed the sphericity and volume fraction have significant impact on the bed pressure drop and average drag coefficient of the particles in the bed especially in high Reynolds number regime. The bed of the spheroid experiences the lowest drag being the most streamlined particle, and the particles with the edges result in a large drag coefficient due to flow separation at the discontinuity. The vector plots verify this behavior where large wake regions are observed behind the tetrahedron particle.

Mahyawansi, Pratik↗
DOE OSTI2023

Electronic structure and correlations in planar trilayer nickelate Pr 4 Ni 3 O 8

The discovery of superconductivity in planar nickelates raises the question of how the electronic structure and correlations of Ni 1+ compounds compare to those of the Cu 2+ cuprate superconductors. Here, we present an angle-resolved photoemission spectroscopy (ARPES) study of the trilayer nickelate Pr 4 Ni 3 O 8 , revealing a Fermi surface resembling that of the hole-doped cuprates but with critical differences. Specifically, the main portions of the Fermi surface are extremely similar to that of the bilayer cuprates, with an additional piece that can accommodate additional hole doping. We find that the electronic correlations are about twice as strong in the nickelates and are almost k-independent, indicating that they originate from a local effect, likely the Mott interaction, whereas cuprate interactions are somewhat less local. Nevertheless, the nickelates still demonstrate the strange-metal behavior in the electron scattering rates. Understanding the similarities and differences between these two families of strongly correlated superconductors is an important challenge.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2022

Correlating Crystallography, Magnetism, and Electronic Structure Across Anhysteretic First-Order Phase Transition in Pr 2 In

Here, temperature-dependent powder X-ray diffraction and magnetization measurements of Pr 2 In conclusively prove that the unusual anhysteretic first-order paramagnetic-ferromagnetic phase transition in the compound is related to concurrent changes in both the magnetic and crystallographic lattices. At the same time, the hexagonal Ni 2 In-type structure is stable at least between 6 and 298 K, including at T C = ~57 K. From the density functional theory calculations, the electronic structure of the compound is extraordinarily sensitive to minor changes in lattice parameters that occur across the phase transition, revealing the origin of strong magnetoelastic coupling. In the vicinity of T C , the maximum entropy change, ΔS Max = -16 J Kg -1 K -1 induced by a moderate magnetic field change of 20 kOe (ΔS Max = -20 J Kg -1 K -1 for 50 kOe magnetic field change) is comparable to other known potentially functional materials demonstrating large cryogenic magnetocaloric effect.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

SST-TG-P1F4R3200: Decaying Stably-Stratified Turbulence (SST), Initialized Using Taylor-Green Vortices (TG) at Prandtl Number Pr=1, Froude Number Fr=4, Reynolds Number Re=3200

This dataset comprises direct numerical simulations (DNS) of decaying stably-stratified turbulence influenced by a linear background density gradient, initialized using an array of Taylor-Green vortices, as described in [Riley & de Bruyn Kops (2003)](https://doi.org/10.1063/1.1578077). The initial Prandtl, Froude, and Reynolds numbers are (Pr, Fr, Re) = (1, 4, 3200). A total of 15,000 snapshots are recorded at uniform time intervals, each with a spatial resolution of 512x512x256 grid points. Four flow variables are associated with each snapshot: the three velocity components (u,v,w) and the perturbed density field (rho) away from the background gradient. All fields are stored in binary format (32-bit little-endian), each with a size of 255 MB, yielding a total dataset size of 15.3 TB. Further details are referenced in the attached README file, and a current list of publications and associated analysis tools are provided at https://stratified-turbulence.github.io/web/.

42 ENGINEERING↗
DOE OSTI2021

AmeriFlux PR-xGU NEON Guanica Forest (GUAN)

This is the AmeriFlux version of the carbon flux data for the site PR-xGU NEON Guanica Forest (GUAN). Site Description - The Guanica Forest (GUAN) site is located on the southwest corner of the main island of Puerto Rico in a protected forest with primary phenological species of Gymnanthes lucida, Pisonia albida, and Bursera simaruba. The mean canopy height is approximately 10 m.

Network), NEON (National Ecological Observatory↗
DOE OSTI2021

AmeriFlux PR-xLA NEON Lajas Experimental Station (LAJA)

This is the AmeriFlux version of the carbon flux data for the site PR-xLA NEON Lajas Experimental Station (LAJA). Site Description - The NEON Lajas Experimental Station (LAJA) site is located on the southwest corner of the main island of Puerto Rico in a experimental range. This is a grassland site that is periodically grazed by cattle.

Network), NEON (National Ecological Observatory↗
DOE OSTI2022

Puerto Rico Demand Response Impact and Forecast Tool (PR-DRIFT) - Beta Version [Slides]

Due to high fossil fuel imports, high electricity rates, an unreliable electricity grid, and 100% renewable electricity goals, demand response can play a crucial role for the Puerto Rico electricity grid. The Puerto Rico Demand Response Impact and Forecast Tool (PR-DRIFT) is a spreadsheet-based tool in which users can estimate the potential impacts of demand response, energy efficiency, and VRE and storage adoption in Puerto Rico from 2021 through 2040. The tool includes projections for solar, wind, and battery adoption based on released RFPs and energy targets (including Act-17 2019) to generate a projected net load profile for each hour through 2040. Based on user inputs and default assumptions, the tool also projects load profile impacts of demand response and energy efficiency, and is specifically focused on highlighting projected demand response technical potential. This demand response technical potential can be used by local utilities, regulators, program administrators, or researchers to help design demand response programs for larger impact.

24 POWER TRANSMISSION AND DISTRIBUTION↗
DOE OSTI2020

PV Rooftop Database for Puerto Rico (PVRDB-PR)

The National Renewable Energy Laboratory's (NREL) PV Rooftop Database for Puerto Rico (PVRDB-PR) is a lidar-derived, geospatially-resolved dataset of suitable roof surfaces and their PV technical potential for virtually all buildings in Puerto Rico. The dataset can be downloaded at the AWS S3 explorer page. The GitHub documentation page provides a description of the dataset with methods and assumptions. The Puerto Rico Solar-For-All dataset provides Census Tract level estimates of residential low-to-moderate income (LMI) PV rooftop technical potential as well as solar electric bill savings potential for LMI communities at the municipality level.

Array↗
DOE OSTI2020

Materials Data on Pr(Sb3Os)4 by Materials Project

PrOs4Sb12 is Skutterudite-derived structured and crystallizes in the cubic Im-3 space group. The structure is three-dimensional and consists of two praseodymium molecules and one OsSb3 framework. In the OsSb3 framework, Os+0.75- is bonded to six equivalent Sb atoms to form corner-sharing OsSb6 octahedra. The corner-sharing octahedral tilt angles are 55°. All Os–Sb bond lengths are 2.65 Å. Sb is bonded in a 2-coordinate geometry to two equivalent Os+0.75- and two equivalent Sb atoms. There are one shorter (2.96 Å) and one longer (3.02 Å) Sb–Sb bond lengths.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pr(MoO2)6 by Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pr(SiP3)2 by Materials Project

PrSi2P5P crystallizes in the orthorhombic Cmc2_1 space group. The structure is two-dimensional and consists of sixteen phosphine molecules; sixteen praseodymium molecules; and four Si2P5 sheets oriented in the (0, 1, 0) direction. In each Si2P5 sheet, there are four inequivalent Si4- sites. In the first Si4- site, Si4- is bonded to four P+0.83+ atoms to form corner-sharing SiP4 tetrahedra. There are a spread of Si–P bond distances ranging from 2.23–2.30 Å. In the second Si4- site, Si4- is bonded to four P+0.83+ atoms to form corner-sharing SiP4 tetrahedra. There are a spread of Si–P bond distances ranging from 2.24–2.28 Å. In the third Si4- site, Si4- is bonded to four P+0.83+ atoms to form corner-sharing SiP4 tetrahedra. There are a spread of Si–P bond distances ranging from 2.20–2.29 Å. In the fourth Si4- site, Si4- is bonded to four P+0.83+ atoms to form corner-sharing SiP4 tetrahedra. There are a spread of Si–P bond distances ranging from 2.24–2.28 Å. There are twelve inequivalent P+0.83+ sites. In the first P+0.83+ site, P+0.83+ is bonded in a water-like geometry to two Si4- atoms. In the second P+0.83+ site, P+0.83+ is bonded in an L-shaped geometry to two equivalent Si4- atoms. In the third P+0.83+ site, P+0.83+ is bonded in a water-like geometry to two equivalent Si4- atoms. In the fourth P+0.83+ site, P+0.83+ is bonded in a water-like geometry to two equivalent Si4- atoms. In the fifth P+0.83+ site, P+0.83+ is bonded in a water-like geometry to two Si4- atoms. In the sixth P+0.83+ site, P+0.83+ is bonded in a single-bond geometry to one Si4- atom. In the seventh P+0.83+ site, P+0.83+ is bonded in a single-bond geometry to one Si4- atom. In the eighth P+0.83+ site, P+0.83+ is bonded in a single-bond geometry to one Si4- atom. In the ninth P+0.83+ site, P+0.83+ is bonded in a water-like geometry to two Si4- atoms. In the tenth P+0.83+ site, P+0.83+ is bonded in a water-like geometry to two Si4- atoms. In the eleventh P+0.83+ site, P+0.83+ is bonded in a water-like geometry to two equivalent Si4- atoms. In the twelfth P+0.83+ site, P+0.83+ is bonded in a single-bond geometry to one Si4- atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pr(P3Os)4 by Materials Project

PrOs4P12 crystallizes in the cubic Im-3 space group. The structure is three-dimensional and consists of two praseodymium molecules and one OsP3 framework. In the OsP3 framework, Os+1.75- is bonded to six equivalent P+0.33+ atoms to form distorted corner-sharing OsP6 octahedra. The corner-sharing octahedral tilt angles are 62°. All Os–P bond lengths are 2.38 Å. P+0.33+ is bonded in a bent 120 degrees geometry to two equivalent Os+1.75- atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pr(WO4)2 by Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

36 MATERIALS SCIENCE↗