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Elham Mazarei

2 results in Authors: Elham Mazarei

Theoretical and Computational Chemistry

Surface Hopping Molecular Dynamics Simulations for Photophysics and Photoreactions Involving Pyrene and CH3Cl

Elham Mazarei, Evgenii Titov, Peter Saalfrank

Version 1 posted 16 April 2025

85

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Theoretical and Computational Chemistry

Band gap engineering in two-dimensional materials by functionalization: Methylation of graphene and graphene bilayers

Elham Mazarei, Christopher Penschke, Peter Saalfrank

Version 3 posted 10 May 2023

338

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