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Multiscale Materials Modeling Laboratory

Recent Publications

May 1, 2026

Applied Surface Science Advances

34, 100993 (2026)


Ferroelectric polarization and bandgap engineering in perovskite oxide via sulfur diffusion
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April 10, 2026

Solid State Sciences

177, 108330 (2026)


Multifunctional properties of Mn-doped InP: Unveiling ferroelectric, ferromagnetic, and magnetoelectric behaviors
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March 1, 2025

Computational Condensed Matter

42, e00997 (2025)


Magneto-optic and photocatalytic response of CuCrX3 (X=Cl, Br, I) for energy storage applications
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