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Hydrogen and the Light-Induced Bias Instability Mechanism in Amorphous Oxide Semiconductors.
Hydrogen is known to be present as an impurity in amorphous oxide semiconductors at the 0.1% level. Using amorphous ZnO as a simplified model system, we show that the hydrogens pair up at oxygen vacancies in the amorphous...
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Termination-dependence of Fermi level pinning at rare-earth arsenide/GaAs interfaces
ABSTRACT The properties of metal/semiconductor interfaces are generally described by the metal-induced gap states (MIGS) model. However, rare-earth (RE) arsenide interfaces are found not to follow the MIGS model in having very...
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Extending the metal-induced gap state model of Schottky barriers
Fermi level pinning at Schottky barriers strongly limits the minimization of contact resistances in devices and thereby limits the scaling of modern Si electronic devices, so it is useful to understand the full range of...
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Modelling the enthalpy change and transition temperature dependence of the metal-insulator transition in pure and doped vanadium dioxide.
We compare various calculation methods to determine the electronic structures and energy differences of the phases of VO2. We show that density functional methods in the form of GGA+U are able to describe the enthalpy difference...
Published by: Phys Chem Chem Phys
Ab Initio Study of Hexagonal Boron Nitride as the Tunnel Barrier in Magnetic Tunnel Junctions.
Two-dimensional hexagonal boron nitride (h-BN) is studied as a tunnel barrier in magnetic tunnel junctions (MTJs) as a possible alternative to MgO. The tunnel magnetoresistance (TMR) of such MTJs is calculated as a function of...
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Face Dependence of Schottky Barriers Heights of Silicides and Germanides on Si and Ge.
Density functional supercell calculations of the Schottky barrier heights (SBH) of metal germanides and silicides on Si or Ge find that these vary with the facet, unlike those of elemental metals. In addition, silicides and...
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Machine‐learning‐based interatomic potentials for advanced manufacturing
Abstract: This paper summarizes the progress of machine‐learning‐based interatomic potentials and their applications in advanced manufacturing. Interatomic potential is essential for classical molecular dynamics. The...
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A durable and pH-universal self-standing MoC-Mo2C heterojunction electrode for efficient hydrogen evolution reaction.
Efficient water electrolyzers are constrained by the lack of low-cost and earth-abundant hydrogen evolution reaction (HER) catalysts that can operate at industry-level conditions and be prepared with a facile process. Here we...
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A durable and pH-universal self-standing MoC-Mo2C heterojunction electrode for efficient hydrogen evolution reaction.
Efficient water electrolyzers are constrained by the lack of low-cost and earth-abundant hydrogen evolution reaction (HER) catalysts that can operate at industry-level conditions and be prepared with a facile process. Here we...
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Defect passivation of transition metal dichalcogenides via a charge transfer van der Waals interface.
Integration of transition metal dichalcogenides (TMDs) into next-generation semiconductor platforms has been limited due to a lack of effective passivation techniques for defects in TMDs. The formation of an organic-inorganic...
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Phase boundary engineering of metal-organic-framework-derived carbonaceous nickel selenides for sodium-ion batteries
Abstract: Sodium-ion batteries (SIBs) are promising power sources due to the low cost and abundance of battery-grade sodium resources, while practical SIBs suffer from intrinsically sluggish diffusion kinetics and severe volume...
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The Association Between Food Addiction and Weight Status in School-Age Children and Adolescents.
BACKGROUND: The association between food addiction (FA) and weight status in children and adolescents remains poorly understood. This study aimed to elucidate the association between FA and weight status using the validated...
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The Association Between Food Addiction and Weight Status in School-Age Children and Adolescents.
Background: The association between food addiction (FA) and weight status in children and adolescents remains poorly understood. This study aimed to elucidate the association between FA and weight status using the validated...
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Double-Layer Learning, Leaders' Forgetting, and Knowledge Performance in Online Work Community Organizations
This paper constructs an online community organizational double-layer learning structure model based on exploration-exploitation models. In this way, the authors examine the effect how double-layer online community learning as...
Selective Chemical Vapor Deposition Growth of WS2/MoS2 Vertical and Lateral Heterostructures on Gold Foils.
Vertical and lateral heterostructures consisting of atomically layered two-dimensional (2D) materials exhibit intriguing properties, such as efficient charge/energy transfer, high photoresponsivity, and enhanced photocatalytic...
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