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Fe/GeTe(111) heterostructures as an avenue towards spintronics based on ferroelectric Rashba semiconductors (open access)

Fe/GeTe(111) heterostructures as an avenue towards spintronics based on ferroelectric Rashba semiconductors

Article investigating the electronic structure of Fe/GeTe(111), a prototypical ferromagnetic/Rashba-ferroelectric interface, by performing density functional theory and Green's functions calculations complemented by x-ray photoemission spectroscopy.
Date: February 19, 2019
Creator: Sławińska, Jagoda; Di Sante, Domenico; Varotto, Sara; Rinaldi, Christian & Picozzi, Silvia
Object Type: Article
System: The UNT Digital Library
Persistent spin helix in Rashba-Dresselhaus ferroelectric CsBiNb2O7 (open access)

Persistent spin helix in Rashba-Dresselhaus ferroelectric CsBiNb2O7

Article reporting that CsBiNb₂O₇, a layered perovskite of Dion-Jacobson type, is a robust ferroelectric with sufficiently strong spin-orbit coupling and spin texture reversible by electric field. The study reveals that its topmost valence band's spin texture is quasi-independent from the momentum, as a result of the low symmetry of its ferroelectric phase. The peculiar spin-polarization pattern in the momentum space may yield the so-called “persistent spin helix,” a specific spin-wave mode which protects the spin from decoherence in the diffusive transport regime, potentially ensuring a very long spin lifetime in this material.
Date: August 19, 2019
Creator: Sławińska, Jagoda; Autieri, Carmine; Barone, Paolo & Picozzi, Silvia
Object Type: Article
System: The UNT Digital Library
Deep Minima and Vortices for Positronium Formation in Low-Energy Positron-Hydrogen Collisions (open access)

Deep Minima and Vortices for Positronium Formation in Low-Energy Positron-Hydrogen Collisions

Article using the two-channel Kohn inverse and Kohn variational methods to investigate ground-state positronium (Ps) formation in positron-hydrogen collisions in the Ore gap. This is the Accepted Manuscript Version of the article.
Date: September 30, 2019
Creator: Alrowaily, Albandari W.; Quintanilla, Sandra J. & Van Reeth, P.
Object Type: Article
System: The UNT Digital Library
Label-free characterization of white blood cells using fluorescence lifetime imaging and flow-cytometry: molecular heterogeneity and erythrophagocytosis [Invited] (open access)

Label-free characterization of white blood cells using fluorescence lifetime imaging and flow-cytometry: molecular heterogeneity and erythrophagocytosis [Invited]

Article reporting the results of blood cell characterization using label-free fluorescence imaging techniques and flow-cytometry. Autofluorescence parameters of different cell types – white blood cells, red blood cells, erythrophagocytic cells – are assessed and analyzed in terms of molecular heterogeneity and possibilities of differentiation between different cell types in vitro and in vivo.
Date: July 29, 2019
Creator: Drachev, Vladimir P.; Yakimov, Boris P.; Gogoleva, Maria A.; Semenov, Alexey N.; Rodionov, Sergey A.; Novoselova, Marina V. et al.
Object Type: Article
System: The UNT Digital Library
Absorption and emission modulation in a MoS2–GaN (0001) heterostructure by interface phonon–exciton coupling (open access)

Absorption and emission modulation in a MoS2–GaN (0001) heterostructure by interface phonon–exciton coupling

Article reporting the change in the transient absorption characteristics of monolayer MoS2 and the modified PL emission characteristics in a monolayer MoS2–GaN (0001) heterostructure due to the coupling of carriers with the phonon modes and the energy exchange at the interface. The results demonstrate the relevance of interface coupling between the semiconductors for the development of optical and electronic applications.
Date: September 26, 2019
Creator: Poudel, Yuba; Sławińska, Jagoda; Gopal, Priya; Seetharaman, Sairaman; Hennighausen, Zachariah; Kar, Swastik et al.
Object Type: Article
System: The UNT Digital Library
Grand canonical simulations of electrochemical interfaces in implicit solvation models (open access)

Grand canonical simulations of electrochemical interfaces in implicit solvation models

Article discussing grand canonical simulations based on density-functional theory to study the thermodynamic properties of electrochemical interfaces of metallic electrodes in aqueous environments.
Date: August 31, 2018
Creator: Hörmann, Nicolas; Andreussi, Oliviero & Marzari, Nicola
Object Type: Article
System: The UNT Digital Library
Continuum models of the electrochemical diffuse layer in electronic-structure calculations (open access)

Continuum models of the electrochemical diffuse layer in electronic-structure calculations

This article presents a critical comparison of continuum diffuse-layer models that can be coupled to an atomistic first-principles description of the charged metal surface in order to account for the electrolyte screening at electrified interfaces.
Date: August 31, 2018
Creator: Nattino, Francesco; Truscott, Matthew; Marzari, Nicola & Andreussi, Oliviero
Object Type: Article
System: The UNT Digital Library
Formation and characterization of embedded Fe3Si binary structures in Si (open access)

Formation and characterization of embedded Fe3Si binary structures in Si

Article studying chemical and electronic properties of ion beam synthesized Fe-Si binary structures using X-ray photoelectron spectroscopy binding energy analysis.
Date: May 16, 2019
Creator: Lakshantha, Wickramaarachchige J.; McDaniel, Floyd Del. (Floyd Delbert), 1942- & Rout, Bibhudutta
Object Type: Article
System: The UNT Digital Library
Polarization in electrostatics and circuits: Computing and visualizing surface charge distributions (open access)

Polarization in electrostatics and circuits: Computing and visualizing surface charge distributions

Article describing an algorithm or computing the detailed surface charge distributions in equilibrium electrostatic situations and in steady-state DC circuits, and discuss the results of the computations of surface charge distributions for several systems.
Date: December 14, 2018
Creator: Chabay, Ruth & Sherwood, Bruce
Object Type: Article
System: The UNT Digital Library
AFLOW-QHA3P: Robust and automated method to compute thermodynamic properties of solids (open access)

AFLOW-QHA3P: Robust and automated method to compute thermodynamic properties of solids

Article introducing the quasiharmonic approximation three-phonon method to calculate the thermodynamic properties of both nonmetallic and metallic compounds. This study demonstrates that QHA3P is an ideal framework for the high-throughput prediction of finite-temperature material properties, combining the accuracy of QHA with the computational efficiency of SC-QHA.
Date: July 8, 2019
Creator: Nath, Pinku; Usanmaz, Demet; Hicks, David; Oses, Corey; Fornari, Marco; Buongiorno Nardelli, Marco et al.
Object Type: Article
System: The UNT Digital Library
Discovery of the first heavily obscured QSO candidate at z > 6 in a close galaxy pair (open access)

Discovery of the first heavily obscured QSO candidate at z > 6 in a close galaxy pair

This article reports the Chandra discovery of the first heavily obscured QSO candidate in the early universe, hosted by a close (≈5 kpc) galaxy pair at z = 6.515.
Date: May 17, 2022
Creator: Vito, F.; Brandt, William Nielsen; Bauer, Franz E.; Gilli, Roberto; Luo, B.; Zamorani, G. et al.
Object Type: Article
System: The UNT Digital Library
Amplification of photoacoustic effect in bimodal polymer particles by self-quenching of indocyanine green (open access)

Amplification of photoacoustic effect in bimodal polymer particles by self-quenching of indocyanine green

This article presents a new type of bimodal contrast agent that is based on the self-quenching of indocyanine green (ICG) encapsulated in a biocompatible and biodegradable polymer shell.
Date: August 23, 2019
Creator: Mokrousov, Maksim D.; Novoselova, Marina V.; Nolan, Jackie; Harrington, Walter; Rudakovskaya, Polina; Bratashov, Daniil N. et al.
Object Type: Article
System: The UNT Digital Library
Electrodynamics of superlattices with ultra-thin metal layers: quantum Landau damping and band gaps with nonzero density of states (open access)

Electrodynamics of superlattices with ultra-thin metal layers: quantum Landau damping and band gaps with nonzero density of states

This article develops a theory of electromagnetic transmission through dielectric-metal superlattices with ultra-thin metal films, in which electron motion in the direction perpendicular to the metal surfaces is quantized.
Date: October 16, 2018
Creator: Castillo-López, S. G.; Krokhin, Arkadii A.; Makarov, N. M. & Pérez-Rodríguez, F.
Object Type: Article
System: The UNT Digital Library
Two-Layer High-Throughput: Effective Mass Calculations Including Warping (open access)

Two-Layer High-Throughput: Effective Mass Calculations Including Warping

Article performing and analyzing two-layer high-throughput calculations.
Date: February 26, 2022
Creator: Supka, Andrew; Mecholsky, Nicholas A.; Buongiorno Nardelli, Marco; Curtarolo, Stefano & Fornari, Marco
Object Type: Article
System: The UNT Digital Library
Ice imaging in aircraft anti-icing fluid films using polarized light (open access)

Ice imaging in aircraft anti-icing fluid films using polarized light

Article presents how to enhance ice contrast in the visible spectrum by using ice birefringence and polarized light reflection. The method can be used for both visual inspection and automatic ice detection systems.
Date: December 13, 2021
Creator: Grishaev, Viktor G.; Usachev, Igor A.; Drachev, Vladimir P.; Gattarov, Ramil K.; Rudenko, Nadezhda I.; Amirfazli, Alidad et al.
Object Type: Article
System: The UNT Digital Library
The allometric propagation of COVID-19 is explained by human travel (open access)

The allometric propagation of COVID-19 is explained by human travel

Article develops an allometric model capable of fitting the initial phase of the COVID-19 pandemic and predicting the propagation of the illness for up to 100 days.
Date: December 18, 2021
Creator: Tuladhar, Rohisha; Grigolini, Paolo & Santamaria, Fidel
Object Type: Article
System: The UNT Digital Library
Optimization of the Observing Cadence for the Rubin Observatory Legacy Survey of Space and Time: A Pioneering Process of Community-focused Experimental Design (open access)

Optimization of the Observing Cadence for the Rubin Observatory Legacy Survey of Space and Time: A Pioneering Process of Community-focused Experimental Design

This article is part of a Focus Issue on the topic of Rubin LSST Survey Strategy Optimization. The motivation, history, and decision-making process of the observing strategy optimization are detailed, giving context to the science-driven proposals and recommendations for the survey strategy included in this Focus Issue.
Date: December 22, 2021
Creator: Bianco, Federica B.; Ivezić, Željko; Jones, R. Lynne; Graham, Melissa L.; Marshall, Phil; Saha, Abhijit et al.
Object Type: Article
System: The UNT Digital Library
Connecting Low- and High-redshift Weak Emission-line Quasars via Hubble Space Telescope Spectroscopy of Lyα Emission (open access)

Connecting Low- and High-redshift Weak Emission-line Quasars via Hubble Space Telescope Spectroscopy of Lyα Emission

Article presents ultraviolet spectroscopy covering the Lyα + N v complex of six candidate low-redshift (0.9 < z < 1.5) weak emission-line quasars (WLQs) based on observations with the Hubble Space Telescope.
Date: April 14, 2022
Creator: Paul, Jeremiah D.; Plotkin, Richard M.; Shemmer, Ohad; Anderson, Scott F.; Brandt, W. N.; Fan, Xiaohui et al.
Object Type: Article
System: The UNT Digital Library
Momentum-Space Spin Antivortex and Spin Transport in Monolayer Pb (open access)

Momentum-Space Spin Antivortex and Spin Transport in Monolayer Pb

This article finds a nontrivial spin texture, spin antivortex, can appear at certain momenta on the Γ− K line in a 2D monolayer Pb on top of SiC.
Date: April 21, 2022
Creator: Yang, Kaijie; Wang, Yuanxi & Liu, Chao-Xing
Object Type: Article
System: The UNT Digital Library
Relaxation time approximations in PAOFLOW 2.0 (open access)

Relaxation time approximations in PAOFLOW 2.0

Article presents the implementation of relaxation time approximation models in the calculation of Boltzmann transport in PAOFLOW 2.0 and applies those to model band-structures. In addition, using a self-consistent fitting of the model parameters to experimental conductivity data, the authors provide a flexible tool to extract scattering rates with high accuracy. They illustrate the approximations using simple models and then apply the method to GaAs, Si, Mg₃Sb₂, and CoSb₃.
Date: March 23, 2022
Creator: Jayaraj, Anooja; Siloi, Ilaria; Fornari, Marco & Buongiorno Nardelli, Marco
Object Type: Article
System: The UNT Digital Library
Low-Energy Atomic Processes Including Ones Involving a Positron (open access)

Low-Energy Atomic Processes Including Ones Involving a Positron

Data management plan for the grant, "Low-Energy Atomic Processes Including Ones Involving a Positron." The proposed research in theoretical atomic physics involves few-body systems of charged particles, especially ones that involve the antiparticle of the electron, which is a positron. One of these systems is the positronium negative ion, which is comprised of two electrons and a positron. The exotic positronium atom is similar to the conventional hydrogen atom, but the positive charge in the atom is a positron rather than a proton. The proposed studies of these few-body charged systems will support international collaborations with scientists in the UK and Japan.
Date: 2022-09-01/2025-08-31
Creator: Quintanilla, Sandra J.
Object Type: Text
System: The UNT Digital Library
Connecting Galaxies and Supermassive Black Holes: Meso-scale Simulations of Multiphase Accretion Flows (open access)

Connecting Galaxies and Supermassive Black Holes: Meso-scale Simulations of Multiphase Accretion Flows

Data management plan for the grant, "Connecting Galaxies and Supermassive Black Holes: Meso-scale Simulations of Multiphase Accretion Flows." It proposes to study how gas flows onto the supermassive black holes in massive galaxies and galaxy clusters. They will perform numerical simulations with a nested zoom-in technique, focusing on the mesoscale accretion flows from the Bondi radius to hundreds of Schwarzschild radii. They will predict the mass flux of different phases, as well as their angular momentum and magnetic flux.
Date: 2022-07-01/2025-06-30
Creator: Li, Yuan
Object Type: Text
System: The UNT Digital Library
Detection of Pancreatic Cancer miRNA with Biocompatible Nitrogen-Doped Graphene Quantum Dots (open access)

Detection of Pancreatic Cancer miRNA with Biocompatible Nitrogen-Doped Graphene Quantum Dots

Article detects the presence of a specific pancreatic cancer-derived miRNA (pre-miR-132) using the fluorescence properties of biocompatible nitrogen-doped graphene quantum dots (NGQDs) synthesized using a bottom-up approach from a single glucosamine precursor. This non-invasive approach allows cancer-specific miRNA detection to facilitate early diagnosis of various forms of cancer.
Date: August 20, 2022
Creator: Ajgaonkar, Ryan; Lee, Bong; Valimukhametova, Alina; Nguyen, Steven; Gonzalez-Rodriguez, Roberto; Coffer, Jeffery et al.
Object Type: Article
System: The UNT Digital Library
Collaborative Research: PIC: Slow Wave Enhanced Electrooptically Tuned Michelson Interferometer Biosensor for On-Chip Polarization Interferometry (open access)

Collaborative Research: PIC: Slow Wave Enhanced Electrooptically Tuned Michelson Interferometer Biosensor for On-Chip Polarization Interferometry

Data management plan for the grant, "Collaborative Research: PIC: Slow Wave Enhanced Electrooptically Tuned Michelson Interferometer Biosensor for On-Chip Polarization Interferometry."
Date: 2022-09-01/2025-08-31
Creator: Rout, Bibhudutta
Object Type: Text
System: The UNT Digital Library