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The 2019 materials by design roadmap

Description: This roadmap article presents an overview of the current state of computational materials prediction, synthesis and characterization approaches, materials design needs for various technologies, and future challenges and opportunities that must be addressed.
Date: October 24, 2018
Creator: Alberi, Kirstin; Buongiorno Nardelli, Marco; Zakutayev, Andriy; Mitas, Lubos; Curtarolo, Stefano; Jain, Anubhav et al.
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Partner: UNT College of Science
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The 4Ms Chandra Deep Field-South Number Counts Apportioned By Source Class: Pervasive Active Galactic Nuclei and the Ascent of Normal Galaxies

Description: This article presents cumulative and differential number-count measurements for the recently completed 4 Ms Chandra Deep Field-South survey.
Date: April 9, 2012
Creator: Lehmer, Bret; Xue, Yongquan; Brandt, William Nielsen; Alexander, David M.; Bauer, Franz E.; Brusa, Marcella et al.
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Partner: UNT College of Arts and Sciences
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Absolute band alignment at semiconductor-water interfaces using explicit and implicit descriptions for liquid water

Description: Article presents a rigorous and systematic study of the band alignment of semiconductors in aqueous solutions by contrasting a range of hybrid explicit/implicit models against explicit atomistic simulations based on density-functional theory.
Date: October 11, 2019
Creator: Hörmann, Nicolas; Guo, Zhendong; Ambrosio, Francesco; Andreussi, Oliviero; Pasquarello, Alfredo & Marzari, Nicola
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Partner: UNT College of Science
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Absorption and emission modulation in a MoS2–GaN (0001) heterostructure by interface phonon–exciton coupling

Description: 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: December 1, 2019
Creator: Poudel, Yuba; Sławińska, Jagoda; Gopal, Priya; Seetharaman, Sairaman; Hennighausen, Zachariah; Kar, Swastik et al.
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Partner: UNT College of Science
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Accelerator-based fusion with a low temperature target

Description: This article reports a study of a cold target with a high Fermi energy in light of recent research that points to a new phase of hydrogen, which is hypothesized to be related to metallic hydrogen. It has been shown that if the energy transfer between injected ions and target electrons is sufficiently small, net energy gain can be achieved. As such, the target is considered to be composed of nuclei and delocalized electrons.
Date: April 19, 2013
Creator: Phillips, R. E. & Ordonez, Carlos A.
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Partner: UNT College of Arts and Sciences
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AFLOW-QHA3P: Robust and automated method to compute thermodynamic properties of solids

Description: 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.
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Partner: UNT College of Science
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All-acoustic signal modulation and logic operation via defect induced cavity effects in phononic crystal coupled-resonator acoustic waveguides

Description: Article describes experiment where a coupled resonant acoustic waveguide (CRAW) in a phononic crystal (PnC) was engineered to manipulate the propagation of ultrasonic waves within a conventional phononic bandgap for wavelength division multiplexing.
Date: November 6, 2019
Creator: Reyes, Delfino; Walker, Ezekiel; Zubov, Yurii; Heo, Hyeonu; Krokhin, Arkadii A. & Neogi, Arup
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Partner: UNT College of Science
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ALMA Observations Show Major Mergers Among the Host Galaxies of Fast-growing, High-redshift, Supermassive Black Holes

Description: This article presents new ALMA band-7 data for a sample of six luminous quasars at z ≃ 4.8, powered by fast-growing supermassive black holes (SMBHs) with rather uniform properties.
Date: February 3, 2017
Creator: Trakhtenbrot, Benny; Lira, Paulina; Netzer, Hagai; Cicone, Claudia; Maiolino, Roberto & Shemmer, Ohad
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Partner: UNT College of Arts and Sciences
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Amplification of photoacoustic effect in bimodal polymer particles by self-quenching of indocyanine green

Description: 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.
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Partner: UNT College of Science
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Antihydrogen Beam Formation by Transporting an Antiproton Beam Through an Electron-Positron Plasma That Produces Magnetobound Positronium

Description: This paper from the 2016 Conference on Application of Accelerators in Research and Industry conference proceedings describes the use of a classical trajectory simulation to study the formation of an antihydrogen beam by transporting an antiproton beam through an electron-positron plasma that produces magnetobound positronium.
Date: October 26, 2017
Creator: Hermosillo, M.; Thornton, E. A. & Ordonez, Carlos A.
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Partner: UNT College of Science
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Antihydrogen Synthesis Via Magnetobound States of Protonium Within Proton-Positron-Antiproton Plasmas

Description: Article studies the possibility that antihydrogen can be synthesized via three body recombination involving magnetobound protonium through classical trajectory simulation. It has been previously reported that proton antiproton collisions can result in a correlated drift of the particles perpendicular to a magnetic field. While the two particles are in their correlated drift, they are referred to as a magnetobound protonium system. Possible three body recombination resulting in bound state anti… more
Date: July 2016
Creator: Hermosillo, M. & Ordonez, Carlos A.
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Partner: UNT College of Arts and Sciences
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Artificially Structured Boundary as a Charged Particle Beam Deflector Shield

Description: This paper from the 23rd Conference on Application of Accelerators in Research and Industry conference proceedings studies the possibility of using a planar artificially structured boundary as a charged particle beam deflector shield via classical trajectory Monte Carlo simulation.
Date: June 18, 2015
Creator: Hedlof, R. M. & Ordonez, Carlos A.
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Partner: UNT College of Arts and Sciences
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Artificially Structured Boundary for a high purity ion trap or ion source

Description: This article proposes a plasma enclosed by an Artificially Structured Boundary (ASB) as an alternative to existing ion source assemblies. In accelerator applications, many ion sources can have a limited lifetime or frequent service intervals due to sputtering and eventual degradation of the ion source assembly. Ions are accelerated towards the exit canal of positive ion sources, whereas, due to the biasing scheme, electrons or negative ions are accelerated towards the back of the ion source ass… more
Date: August 1, 2014
Creator: Pacheco, J. L.; Ordonez, Carlos A. & Weathers, Duncan L.
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Partner: UNT College of Arts and Sciences
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Artificially structured boundary for confinement of effectively unmagnetized cryogenic antimatter plasmas

Description: The article is from conference proceedings that discuss an artificially structured boundary (ABS) considered to consist of a spatially periodic arrangement of electrostatically plugged magnetic cusps. As envisioned, a non-neutral positron plasma could be confined by an ASB along its edge, and the space charge of the positron plasma would serve to confine an antiproton plasma. If the conditions of the two-species plasma are suitable, production of antihydrogen via three-body recombination for an… more
Date: January 23, 2018
Creator: Hedlof, R. M. & Ordonez, Carlos A.
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Partner: UNT College of Science

Artificially structured boundary plasma trap

Description: This article presents a computer simulation of single-species non-neutral plasma confinement using an artificially structured boundary. The results support the prospect of developing plasma space-charge based confinement, with an unmagnetized plasma of one species of charged particles confined by an electric field produced by an edge-confined plasma of a second species of charged particles.
Date: September 20, 2019
Creator: Hedlof, R. M. & Ordonez, Carlos A.
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Partner: UNT College of Science
open access

Black Hole Growth Is Mainly Linked to Host-galaxy Stellar Mass Rather Than Star Formation Rate

Description: This article investigates the dependence of black hole accretion rate (BHAR) on host-galaxy star formation rate (SFR) and stellar mass in the CANDELS/GOODS-South field in the redshift range of 0.5 ⩽ z < 2.0.
Date: June 15, 2017
Creator: Yang, G.; Chen, C. -T. J.; Vito, F.; Brandt, William Nielsen; Alexander, David M.; Luo, Bin et al.
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Partner: UNT College of Science
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