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Results: 76

Slavko Radenković, Miquel Solà
Aromaticity of Osmaacenes in Their Lowest-Lying Singlet and Triplet States
Inorg. Chem., 2022, 62, 9578-9588
DOI: 10.1021/acs.inorgchem.3c01029
OpenAccess: –
Keywords: Aromaticity, Chemical bonding, Excited states, Spin states

Junkai Liu, Haoke Zhang, Lianrui Hu, Jun Wang, Jacky W.Y. Lam, Lluís Blancafort, BenZhong Tang
Through-Space Interaction of Tetraphenylethylene: What, Where, and How
J. Am. Chem. Soc., 2022, 144, 7901-7910
DOI: 10.1021/jacs.2c02381
OpenAccess: –
Keywords: Excited states

Miquel Solà, F. Matthias Bickelhaupt
Particle on a Ring Model for Teaching the Origin of the Aromatic Stabilization Energy and the Hückel and Baird Rules
J. Chem. Educ., 2022, 10, 3497–3501
DOI: 10.1021/acs.jchemed.2c00523
OpenAccess: Link
Keywords: Aromaticity, Chemical bonding, Excited states

O. A. Stasyuk, A. J. Stasyuk, M. Solà, A. A. Voityuk
Nitrogen-doped molecular bowls as electron donors in photoinduced electron transfer reactions
Nanoscale Adv., 2022, 4, 2180-2188
DOI: 10.1039/D2NA00150K
OpenAccess: Link
Keywords: Electron and energy transfer, Excited states, Fullerenes, Photovoltaic materials, Supramolecular chemistry

Ivan Djordjevic, Gautama Wicaksono, Ivan Šolić, Juhi Singh, TanviSushil Kaku, Sierin Lim, ElwinWeiJian Ang, Lluís Blancafort, Terry W.J. Steele
Rapid Activation of Diazirine Biomaterials with the Blue Light Photocatalyst
ACS Appl. Mater. Interfaces, 2021, 13, 36839-36848
DOI: 10.1021/acsami.1c08581
OpenAccess: –
Keywords: Computational chemistry, Excited states, Photochemistry

Sílvia Escayola, Claire Tonnelé, Eduard Matito, Albert Poater, Henrik Ottosson, Miquel Solà, David Casanova
Guidelines for Tuning the Excited State Hückel–Baird Hybrid Aromatic Character of Pro‐Aromatic Quinoidal Compounds
Angew. Chem. Int. Ed., 2021, 60, 10255-10265
DOI: 10.1002/anie.202100261
OpenAccess: –
Keywords: Aromaticity, Chemical bonding, Electron delocalization, Excited states

Lluís Blancafort, Jun Wang
Stability and optical absorption of a comprehensive virtual library of minimal eumelanin oligomer models
Angew. Chem. Int. Ed., 2021, 60, 18800-18809
DOI: 10.1002/anie.202106289
OpenAccess: –
Keywords: Computational chemistry, Density Functional Theory, Excited states, Photochemistry, Spectroscopy

Olga A. Stasyuk, Antony J. Stasyuk, Miquel Solà, Alexander A. Voityuk
[10]CPP‐based inclusion complexes of charged fulleropyrrolidines. Effect of the charge location on the photoinduced electron transfer
Chem. Eur. J., 2021, 27, 8737-8744
DOI: 10.1002/chem.202005516
OpenAccess: –
Keywords: Electron and energy transfer, Endohedral fullerenes, Excited states, Fullerenes, Photovoltaic materials

Weixuan Zeng, Ouissam El Bakouri, Dariusz Szczepanik, Hugo Bronstein, Henrik Ottosson
Excited State Character of Cibalackrot-Type Compounds Interpreted in Terms of Hückel-Aromaticity: A Rationale for Singlet Fission Chromophore Design
Chem. Sci., 2021, 12, 6159-6171
DOI: 10.1039/D1SC00382H
OpenAccess: Link
Keywords: Aromaticity, Chemical bonding, Electron delocalization, Excited states

Olga A. Stasyuk, Antony J. Stasyuk, Miquel Solà, Alexander A. Voityuk
How Do Defects in Carbon Nanostructures Regulate the Photoinduced Electron Transfer Processes? The Case of Phenine Nanotubes
ChemPhysChem, 2021, 22, 1178-1186
DOI: 10.1002/cphc.202100285
OpenAccess: Link
Keywords: Electron and energy transfer, Excited states, Fullerenes, Nanocages, Photovoltaic materials