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Application of phase-field method in rechargeable batteries

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Critical charge transport networks in doped organic semiconductors

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Controlling bimerons as skyrmion analogues by ferroelectric polarization in...

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A Bayesian framework for adsorption energy prediction on bimetallic alloy...

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Quasi-bound states in an NPN-type nanometer-scale graphene quantum dot under...

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Direct observation of large electron–phonon interaction effect on phonon heat...

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Temperature and composition dependent screw dislocation mobility in...

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Machine learning the Hubbard U parameter in DFT+U using Bayesian optimization

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First-principles calculations of hyperfine interaction, binding energy, and...

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Validation of pore network modeling for determination of two-phase transport...

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Multiscale simulation of the focused electron beam induced deposition process

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Dynamic constitutive model of frozen soil that considers the evolution of...

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Dynamics of grain boundary premelting

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Prediction of the Curie temperature considering the dependence of the phonon...

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Structural changes during glass formation extracted by computational homology...

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Elucidating the constitutive relationship of calcium–silicate–hydrate gel...

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Strain control of layer-resolved negative capacitance in superlattices

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Interpretable machine-learning strategy for soft-magnetic property and...

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Predicting materials properties without crystal structure: deep...

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Theoretical investigation on $$\hbox {BeN}_{{2}}$$ BeN 2 monolayer for an...

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