Welcome to M3L!

Multiscale Materials Modeling Laboratory

Recent Publications

Nov. 25, 2025

RSC Advances

15, 47282-47290 (2025)


A computational insight of the physical properties of MoSX (X= Cl, Br, I) for green energy applications
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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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May 21, 2024

Optical and Quantum Electronics

56, 1094 (2024)


Optoelectronic and thermoelectric response of lead free halide double perovskites Rb2AgPX6 (X=Cl, Br, I) for energy storage applications
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