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Single Molecule Junctions With Non-Conventional Architectures, Crafted In Silico

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Publications

Noncovalent Molecular Electronics

Author(s): G. Gryn’ova, C. Corminboeuf
Published in: The Journal of Physical Chemistry Letters, Issue 9/9, 2018, Page(s) 2298-2304, ISSN 1948-7185
DOI: 10.1021/acs.jpclett.8b00980

Guidelines and diagnostics for charge carrier tuning in thiophene-based wires

Author(s): Ganna Gryn'ova, Pauline J. Ollitrault, Clémence Corminboeuf
Published in: Physical Chemistry Chemical Physics, Issue 19/34, 2017, Page(s) 23254-23259, ISSN 1463-9076
DOI: 10.1039/c7cp04295g

Steric “attraction”: not by dispersion alone

Author(s): Ganna Gryn’ova, Clémence Corminboeuf
Published in: Beilstein Journal of Organic Chemistry, Issue 14, 2018, Page(s) 1482-1490, ISSN 1860-5397
DOI: 10.3762/bjoc.14.125

Fine-tuned organic photoredox catalysts for fragmentation-alkynylation cascades of cyclic oxime ethers

Author(s): Franck Le Vaillant, Marion Garreau, Stefano Nicolai, Ganna Gryn'ova, Clemence Corminboeuf, Jerome Waser
Published in: Chemical Science, Issue 9/27, 2018, Page(s) 5883-5889, ISSN 2041-6520
DOI: 10.1039/C8SC01818A

Read between the Molecules: Computational Insights into Organic Semiconductors

Author(s): Ganna Gryn’ova, Kun-Han Lin, Clémence Corminboeuf
Published in: Journal of the American Chemical Society, 2018, ISSN 0002-7863
DOI: 10.1021/jacs.8b07985