CANOLA, SOFIA
CANOLA, SOFIA
DIPARTIMENTO DI CHIMICA "GIACOMO CIAMICIAN"
Assegnisti
A model hamiltonian tuned toward high level ab initio calculations to describe the character of excitonic states in perylenebisimide aggregates
2018 Liu, Wenlan; Canola, Sofia; Köhn, Andreas; Engels, Bernd; Negri, Fabrizia; Fink, Reinhold F.*
Anisotropy of the n-type charge transport and thermal effects in crystals of a fluoro-alkylated naphthalene diimide: a computational investigation
2014 Sofia Canola;Fabrizia Negri
Charge transport parameters for carbon based nanohoops and donor-acceptor derivatives
2019 Canola, Sofia; Graham, Christina; Pérez-Jiménez, Ángel José; Sancho-García, Juan-Carlos; Negri, Fabrizia
Chlorination and tautomerism: A computational and UPS/XPS study of 2-hydroxypyridine ⇌ 2-pyridone equilibrium
2020 Melandri S.; Evangelisti L.; Canola S.; Sa'adeh H.; Calabrese C.; Coreno M.; Grazioli C.; Prince K.C.; Negri F.; Maris A.
Dimer and cluster approach for the evaluation of electronic couplings governing charge transport: Application to two pentacene polymorphs
2016 Canola, Sofia; Pecoraro, Claudia; Negri, Fabrizia
Insights into the mechanism of coreactant electrochemiluminescence facilitating enhanced bioanalytical performance
2020 Zanut A.; Fiorani A.; Canola S.; Saito T.; Ziebart N.; Rapino S.; Rebeccani S.; Barbon A.; Irie T.; Josel H.-P.; Negri F.; Marcaccio M.; Windfuhr M.; Imai K.; Valenti G.; Paolucci F.
Long rylene nanoribbons express polyacetylene-like signatures at their edges
2019 Medina Rivero, Samara; Canola, Sofia; Zeng, Wangdong; Ramírez, Francisco J; Zafra, José L; Wu, Jishan; Negri, Fabrizia; Casado, Juan
Modeling p-type charge transport in thienoacene analogs of pentacene
2016 Canola, Sofia; Pecoraro, Claudia; Negri, Fabrizia
One Molecule, Four Colors: Discovering the Polymorphs of a Thieno(bis)imide Oligomer
2019 Cappuccino, Chiara; Canola, Sofia; Montanari, Giacomo; Lopez, Sergio G.; Toffanin, Stefano; Melucci, Manuela; Negri, Fabrizia*; Maini, Lucia
One- and two-photon absorption properties of quadrupolar thiophene-based dyes with acceptors of varying strengths
2019 Canola S.; Mardegan L.; Bergamini G.; Villa M.; Acocella A.; Zangoli M.; Ravotto L.; Vinogradov S.A.; Di Maria F.; Ceroni P.; Negri F.
Perylene π-Bridges Equally Delocalize Anions and Cations: Proportioned Quinoidal and Aromatic Content
2019 Mayorga Burrezo P.; Zeng W.; Moos M.; Holzapfel M.; Canola S.; Negri F.; Rovira C.; Veciana J.; Phan H.; Wu J.; Lambert C.; Casado J.
Role of the HOMO-1 Orbital on the p-Type Charge Transport of the Fused-Ring Thienoacene DBTDT
2015 Sofia Canola;Fabrizia Negri
The double exciton state of conjugated chromophores with strong diradical character: insights from TDDFT calculations
2018 Canola, Sofia; Casado, Juan; Negri, Fabrizia
The Low Lying Double-Exciton State of Conjugated Diradicals: Assessment of TDUDFT and Spin-Flip TDDFT Predictions
2019 Sofia Canola, Yasi Dai, Fabrizia Negri