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BibTeX file of [Aleksich24] [show it without abstract]

@article{Aleksich24,
    author={Mariya Aleksich and Yeongsu Cho and Daniel W. Paley and Maggie C. Willson and Hawi N. Nyiera and Patience A. Kotei and Vanessa Oklejas and David W. Mittan-Moreau and Elyse A. Schriber and Kara Christensen and Ichiro Inoue and Shigeki Owada and Kensuke Tono and Michihiro Sugahara and Satomi Inaba-Inoue and Mohammad Vakili and Christopher J. Milne and Fabio DallAntonia and Dmitry Khakhulin and Fernando Ardana-Lamas and Frederico Lima and Joana Valerio and Huijong Han and Tamires Gallo and Hazem Yousef and Oleksii Turkot and Ivette J. Bermudez Macias and Thomas Kluyver and Philipp Schmidt and Luca Gelisio and Adam R. Round and Yifeng Jiang and Doriana Vinci and Yohei Uemura and Marco Kloos and Adrian P. Mancuso and Mark Warren and Nicholas K. Sauter and Jing Zhao and Tess Smidt and Heather J. Kulik and Sahar Sharifzadeh and Aaron S. Brewster and J. Nathan Hohman},
    title={Ligand-mediated quantum yield enhancement in 1-{D} silver organothiolate metal--organic chalcogenolates},
    journal={Adv. Funct. Mater.},
    pages={2414914},
    year={2024},
    keywords={European XFEL;},
    url={https://doi.org/10.1002/adfm.202414914},
    doi={10.1002/adfm.202414914},
    abstract={X-ray free electron laser (XFEL) microcrystallography and synchrotron single-crystal crystallography are used to evaluate the role of organic substituent position on the optoelectronic properties of metal--organic chalcogenolates (MOChas). MOChas are crystalline 1D and 2D semiconducting hybrid materials that have varying optoelectronic properties depending on composition, topology, and structure. While MOChas have attracted much interest, small crystal sizes impede routine crystal structure determination. A series of constitutional isomers where the aryl thiol is functionalized by either methoxy or methyl ester are solved by small molecule serial femtosecond X-ray crystallography (smSFX) and single crystal rotational crystallography. While all the methoxy examples have a low quantum yield (0-1%), the methyl ester in the ortho position yields a high quantum yield of 22%. The proximity of the oxygen atoms to the silver inorganic core correlates to a considerable enhancement of quantum yield. Four crystal structures are solved at a resolution range of 0.8--1.0 \AA revealing a collapse of the 2D topology for functional groups in the 2- and 3- positions, resulting in needle-like crystals. Further analysis using density functional theory (DFT) and many-body perturbation theory (MBPT) enables the exploration of complex excitonic phenomena within easily prepared material systems.} }

Mariya Aleksich, Yeongsu Cho, Daniel W. Paley, Maggie C. Willson, Hawi N. Nyiera, Patience A. Kotei, Vanessa Oklejas, David W. Mittan-Moreau, Elyse A. Schriber, Kara Christensen, Ichiro Inoue, Shigeki Owada, Kensuke Tono, Michihiro Sugahara, Satomi Inaba-Inoue, Mohammad Vakili, Christopher J. Milne, Fabio DallAntonia, Dmitry Khakhulin, Fernando Ardana-Lamas, Frederico Lima, Joana Valerio, Huijong Han, Tamires Gallo, Hazem Yousef, Oleksii Turkot, Ivette Bermudez J. Macias, Thomas Kluyver, Philipp Schmidt, Luca Gelisio, Adam R. Round, Yifeng Jiang, Doriana Vinci, Yohei Uemura, Marco Kloos, Adrian P. Mancuso, Mark Warren, Nicholas K. Sauter, Jing Zhao, Tess Smidt, Heather J. Kulik, Sahar Sharifzadeh, Aaron S. Brewster, and Nathan J. Hohman, Ligand-mediated quantum yield enhancement in 1-D silver organothiolate metal–organic chalcogenolates, Adv. Funct. Mater. 2414914 (2024) [abstract][abstract][link]doi:10.1002/adfm.202414914


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