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Grain boundary segregation behavior of Mo atoms in nanocrystalline Ni–Mo alloy.
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- International Journal of Modern Physics B: Condensed Matter Physics; Statistical Physics; Applied Physics, 2024, v. 38, n. 28, p. 1, doi. 10.1142/S021797922450382X
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Electronic Properties of CrB/Co<sub>2</sub>CO<sub>2</sub> Superlattices by Multiple Descriptor‐Based Machine Learning Combined with First‐Principles.
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- Small Methods, 2024, v. 8, n. 8, p. 1, doi. 10.1002/smtd.202301415
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Effect of initial temperature on the plastic deformation of Al/Ni self-propagation welding by molecular dynamics study.
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- Modern Physics Letters B, 2024, v. 38, n. 7, p. 1, doi. 10.1142/S0217984923502500
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Electronic structure and optical property of kagomes graphene doped with IVA group element by the first principles.
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- Modern Physics Letters B, 2024, v. 38, n. 3, p. 1, doi. 10.1142/S0217984923501683
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Effects of deformation direction and temperature on mechanical properties of nanopolycrystal Ni–Co alloy with gradient twin structure.
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- Modern Physics Letters B, 2023, v. 37, n. 11, p. 1, doi. 10.1142/S0217984923500148
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- Article
Influence of S and Se doping on the electronic characteristic and optical properties of T-carbon by first-principles calculation.
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- Modern Physics Letters B, 2022, v. 36, n. 12, p. 1, doi. 10.1142/S0217984922500233
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Shear strain-induced structure relaxation of Ni Σ17 [110](223) grain boundary: A molecular dynamics simulation.
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- Modern Physics Letters B, 2022, v. 36, n. 2, p. 1, doi. 10.1142/S0217984921504017
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- Article
Electronic property of intrinsic point defect system on β–Si<sub>3</sub>N<sub>4</sub> (0001) surface.
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- Modern Physics Letters B, 2021, v. 35, n. 21, p. 1, doi. 10.1142/S0217984921503590
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Shear deformation mechanical performance of Ni–Co alloy nanoplate by molecular dynamics simulation.
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- Modern Physics Letters B, 2021, v. 35, n. 19, p. N.PAG, doi. 10.1142/S0217984921503231
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Effects of temperature and FCC phase size on the deformation mechanism of pure titanium nanopillars: A molecular dynamics simulation.
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- Modern Physics Letters B, 2021, v. 35, n. 15, p. N.PAG, doi. 10.1142/S0217984921502535
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Research on electronic structure and optical characteristic of S-adsorbed 3C–SiC.
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- Modern Physics Letters B, 2020, v. 34, n. 32, p. N.PAG, doi. 10.1142/S0217984920503728
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- Article
First-Principles Study of Electronic Properties of SnO2/CsPbI2Br Interface.
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- Journal of Electronic Materials, 2021, v. 50, n. 4, p. 2129, doi. 10.1007/s11664-021-08743-9
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Preparation and application of nano-Ni–Co alloy.
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- Journal of Nanoparticle Research, 2023, v. 25, n. 7, p. 1, doi. 10.1007/s11051-023-05799-y
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Passivation of PEA+ to CsPbI<sub>3</sub> (110) Surface States: From the First Principles Calculations.
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- Journal of Renewable Materials, 2023, v. 11, n. 3, p. 1293, doi. 10.32604/jrm.2022.023095
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Coupling effect and charge redistribution of cyclo[18]carbons and cyclocarbon oxides on NaCl surface.
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- International Journal of Modern Physics B: Condensed Matter Physics; Statistical Physics; Applied Physics, 2020, v. 34, n. 13, p. N.PAG, doi. 10.1142/S0217979220501386
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Mechanical response and plastic deformation in single- and dual-phase polycrystalline FeNiAl alloys: molecular dynamics analysis.
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- Journal of Materials Science, 2024, v. 59, n. 31, p. 14405, doi. 10.1007/s10853-024-09704-3
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Effect of solute atoms on grain boundary stability of nanocrystalline Ni–Co alloy.
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- Journal of Materials Science, 2022, v. 57, n. 46, p. 21352, doi. 10.1007/s10853-022-08001-1
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Experimental and DFT-D3 study of sensitivity and sensing mechanism of ZnSnO<sub>3</sub> nanosheets to C<sub>3</sub>H<sub>6</sub>O gas.
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- Journal of Materials Science, 2022, v. 57, n. 5, p. 1, doi. 10.1007/s10853-021-06855-5
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First-Principles Study of Discharge Products and Their Stability for Lithium-Nitrogen Batteries.
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- Materials (1996-1944), 2024, v. 17, n. 10, p. 2429, doi. 10.3390/ma17102429
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Electronic and optical properties of the wurtzite-ZnO/CHNHPbI interface: first-principles calculations.
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- Journal of Materials Science, 2017, v. 52, n. 24, p. 13841, doi. 10.1007/s10853-017-1276-2
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Effect of Gradient Nanotwins on Mechanical Properties of Ni–Co Alloy.
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- Physica Status Solidi (B), 2024, v. 261, n. 3, p. 1, doi. 10.1002/pssb.202300440
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Structure, Stability, and Electronic Properties of Hydrogenated Monolayer 2D Silicon Allotropes by First‐Principles Calculation.
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- Physica Status Solidi (B), 2023, v. 260, n. 2, p. 1, doi. 10.1002/pssb.202200426
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Dynamics of Edge Dislocation in Ti–O Single Crystal Alloys at the Atomic Scale.
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- Physica Status Solidi (B), 2022, v. 259, n. 8, p. 1, doi. 10.1002/pssb.202100536
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Effect of Co Content and Temperature on Shear Mechanical Properties of Nano‐Polycrystalline Ni–Co Alloy.
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- Physica Status Solidi (B), 2022, v. 259, n. 7, p. 1, doi. 10.1002/pssb.202200064
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Inhomogeneities of charge distribution in porous graphitic carbon nitride g-CxNy nanosheets.
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- European Physical Journal D (EPJ D), 2020, v. 74, n. 12, p. 1, doi. 10.1140/epjd/e2020-10389-7
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Mechanical properties of Al–Co–Cr–Fe–Ni high-entropy alloy: A molecular dynamics simulation.
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- Modern Physics Letters B, 2024, v. 38, n. 26, p. 1, doi. 10.1142/S021798492450218X
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- Article