Results 41 to 50 of about 1,489,241 (187)
Blue Phosphorene Dataset for Graph Neural Network Training
, 2023 Four zip files include the blue phosphorene structures and their total energy evaluated by density functional theory or a Tersoff potential.
Aditya Koneru (15187488) +3 more
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Biosensors, 2023 The surface plasmon resonance (SPR) signal, generated from the Kretschmann configuration, has been developed as an effective detection technology in chemical and biological sensors. The sensitivity of SPR signals to changes in the surrounding media makes
Xixi Yuan, Leiming Wu, Yuwen Qin
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, 2021 We have carried out diffusion Monte Carlo calculations for an A1B–1-stacked bilayer blue phosphorene to find that it undergoes a semiconductor–metal transition as the interlayer distance decreases.
Gwangyoung Lee (9567202) +11 more
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Nanophotonics, 2019 Unlike traditional two-dimensional layered materials, tellurium (Te) shows its one-dimensional van der Waals structure and triggers intensive researches. Through a density functional theory coupled with the nonequilibrium Green’s function calculation, we
Gao Siyan, Sun Changqing, Zhang Xi
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Uniaxial Strain-Induced Indirect-to-Direct Band Gap Transition in Blue Phosphorus [PDF]
فیزیک کاربردی ایرانTwo-dimensional blue phosphorus is a monolayer allotrope with a hexagonal lattice, a buckled structure, and a tunable band gap. In this study, the effects of uniaxial strain applied along the zigzag direction on the electronic and vibrational properties ...
Yawar Mohammadi
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Polarization Dynamics in Ferroelectrics: Insights Enabled by Machine Learning Molecular Dynamics
Advanced Science, EarlyView.Machine learning molecular dynamics is presented as a route to capture polarization switching, domain wall kinetics, topological polar textures, and polar mechanical coupling beyond the limits of conventional atomistic methods. This Perspective surveys recent progress and identifies key methodological directions, including long‐range electrostatics ...
Dongyu Bai +3 more
wiley +1 more source
, 2017 Using first principles calculations we investigate the effect of external electric fields in the optical and electronic properties of blue-phosphorene nanoribbons.
Ospina D.A. +3 more
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Structural, electronic, and electromechanical properties of MoSSe/blue phosphorene heterobilayer
AIP Advances, 2019 Two-dimensional (2D) materials attract considerable interest due to their outstanding electronic and mechanical properties. Although extensive efforts have been made on seeking of new kinds of 2D materials, individual ones can hardly offer all required ...
Xiaobao Li +4 more
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Advanced Intelligent Discovery, EarlyView.Machine learning serves as a central engine for the intelligent characterization of two‐dimensional materials by integrating multimodal techniques, including optical microscopy, spectroscopy, electron microscopy, and scanning probe microscopy (SPM). This unified framework enables automated, high‐throughput, and quantitative extraction of structural ...
Zhi‐Long Cao, Jia‐Xu Yan
wiley +1 more source
ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.Low‐dimensional materials (0D, 1D, and 2D) exhibit unique electronic and physicochemical properties, enabling advanced nanoelectronic and optoelectronic devices. Mixed‐dimensional heterostructures combine these materials to enhance functionality.
Qaisar Alam +3 more
wiley +1 more source