Sahar Sharifzadeh

Boston University — United States

Engineering · Physical Sciences

26h-index3.0kcitations146works3.62yr avg
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Research Topics

Molecular Junctions and Nanostructures(42), Organic Electronics and Photovoltaics(20), Spectroscopy and Quantum Chemical Studies(15), Advanced Chemical Physics Studies(14), Mechanical and Optical Resonators(13)

Publications146 total

First-principles investigation of sulfur and sulfur-oxide compounds as potential optically active defects on (6,5) SWCNT
Materials Advances·2025Open Access
Investigating Electron Conductivity Regimes in the Bacterial Cytochrome Wire OmcS
The Journal of Physical Chemistry B·2025· 1 citedOpen Access
Ferroelectric phase transition in group-IV monochalcogenides from an equivariant machine learned force field
Physical Review Materials·2025
Near-Infrared Emission from Sulfur Heteroatom Defects in Single-Walled Carbon Nanotubes
The Journal of Physical Chemistry C·2025
Mo Atom Rearrangement Drives Layer-Dependent Reactivity in Two-Dimensional MoS<sub>2</sub>
Journal of the American Chemical Society·2025· 2 cited
Mo Atom Rearrangement Drives Layer-Dependent Reactivity in Two-Dimensional MoS2
arXiv (Cornell University)·2025Open Access
Identifying Driving and Spectator Phonon Modes in Pentacene Exciton Transport
Journal of the American Chemical Society·2025
Chemical Mapping of Nanoparticle–Ligand Interfaces in Optical Nanocavities
Journal of the American Chemical Society·2025Open Access
International Workshop on Electronic Structure 2024 (ES 24)
2025Open Access
Investigating electron conductivity regimes in the bacterial cytochrome wire OmcS
arXiv (Cornell University)·2025· 1 citedOpen Access
Dynamic Electronic Structure Fluctuations in the De Novo Peptide ACC-Dimer Revealed by First-Principles Theory and Machine Learning
Journal of Chemical Information and Modeling·2025Open Access
Dynamic electronic structure fluctuations in the de novo peptide ACC-dimer revealed by first-principles theory and machine learning
2025
Ligand‐Mediated Quantum Yield Enhancement in 1‐D Silver Organothiolate Metal–Organic Chalcogenolates
Advanced Functional Materials·2024· 8 citedOpen Access
Dynamic electronic structure fluctuations in the de novo peptide ACC-dimer revealed by first-principles theory and machine learning
2024Open Access
Machine learning electron-phonon interactions in two-dimensional semiconducting materials: The case of zero-point renormalization
Physical Review Materials·2024· 2 citedOpen Access
Sulfur and sulfur-oxide compounds as potential optically active defects on SWCNTs
arXiv (Cornell University)·2024· 1 citedOpen Access
Electronic Couplings versus Thermal Fluctuations in the Internal Conversion of Perylene Diimides: The Battle to Localize the Exciton
Journal of Chemical Theory and Computation·2024· 4 cited
A framework for nucleation in electrochemical systems and the effect of surface energy on dendrite growth
Journal of Energy Storage·2024· 9 cited
Exciton polaron formation and hot-carrier relaxation in rigid Dion–Jacobson-type two-dimensional perovskites
Nature Materials·2024· 49 citedOpen Access
Machine learning electron-phonon interactions in 2D semiconducting materials: The case of zero-point renormalization
Research Square (Research Square)·2024· 1 citedOpen Access
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Frequent Co-authors

Jeffrey B. Neaton(15), Leeor Kronik(8), D. Kirk Lewis(6), Kasidet Jing Trerayapiwat(5), Steven G. Louie(4), Pierre Darancet(4), Mohammad Reza Rahimpour(4), Emily A. Carter(4), Aliya Mukazhanova(4), Johannes Lischner(3), Jack Deslippe(3), Sivan Refaely‐Abramson(3), Patrick Huang(3), Xuedan Ma(3), Hassiel Negrin‐Yuvero(3), Sebastian Fernández-Alberti(3), Sergei Tretiak(3), Alon A. Gorodetsky(3), Fang Liu(2), Lin Lin(2)