Salvitti, Giovanna; Pizzano, Emanuele; Baroncelli, Filippo; Melandri, Sonia; Evangelisti, Luca; Negri, Fabrizia; Coreno, Marcello; Prince, Kevin C; Ciavardini, Alessandra; Sa'adeh, Hanan; Pori, Matteo; Mazzacurati, Marzia; Maris, Assimo, Spectroscopic and quantum mechanical study of a scavenger molecule: N,N-diethylhydroxylamine, «SPECTROCHIMICA ACTA. PART A, MOLECULAR AND BIOMOLECULAR SPECTROSCOPY», 2022, 281, Article number: 121555 , pp. 1 - 13 [Scientific article]Open Access
Badía-Domínguez, Irene; Canola, Sofia; Hernández Jolín, Víctor; López Navarrete, Juan T; Sancho-García, Juan C; Negri, Fabrizia; Ruiz Delgado, M Carmen, Tuning the Diradical Character of Indolocarbazoles: Impact of Structural Isomerism and Substitution Position, «THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS», 2022, 13, pp. 6003 - 6010 [Scientific article]Open Access
Evangelisti, Luca; Melandri, Sonia; Negri, Fabrizia; Coreno, Marcello; Prince, Kevin C.; Maris, Assimo, UPS, XPS, NEXAFS and Computational Investigation of Acrylamide Monomer, «PHOTOCHEM», 2022, 2, pp. 463 - 478 [Scientific article]Open Access
Fazzi D.; Negri F., Addressing the Elusive Polaronic Nature of Multiple Redox States in a π-Conjugated Ladder-Type Polymer, «ADVANCED ELECTRONIC MATERIALS», 2021, 7, Article number: 2000786 , pp. 1 - 11 [Scientific article]Open Access
Canola S.; Bagnara G.; Dai Y.; Ricci G.; Calzolari A.; Negri F., Addressing the Frenkel and charge transfer character of exciton states with a model Hamiltonian based on dimer calculations: Application to large aggregates of perylene bisimide, «THE JOURNAL OF CHEMICAL PHYSICS», 2021, 154, Article number: 124101 , pp. 1 - 13 [Scientific article]Open Access
Ricci G.; Canola S.; Dai Y.; Fazzi D.; Negri F., Impact of fluoroalkylation on the n-type charge transport of two naphthodithiophene diimide derivatives, «MOLECULES», 2021, 26, Article number: 4119 , pp. 1 - 17 [Scientific article]Open Access
Shen Y.; Xue G.; Dai Y.; Quintero S.M.; Chen H.; Wang D.; Miao F.; Negri F.; Zheng Y.; Casado J., Normal & reversed spin mobility in a diradical by electron-vibration coupling, «NATURE COMMUNICATIONS», 2021, 12, Article number: 6262 , pp. 1 - 8 [Scientific article]Open Access
Gildemeister N.; Ricci G.; Bohner L.; Neudorfl J.M.; Hertel D.; Wurthner F.; Negri F.; Meerholz K.; Fazzi D., Understanding the structural and charge transport property relationships for a variety of merocyanine single-crystals: A bottom up computational investigation, «JOURNAL OF MATERIALS CHEMISTRY. C», 2021, 9, pp. 10851 - 10864 [Scientific article]
Melandri S.; Evangelisti L.; Canola S.; Sa'adeh H.; Calabrese C.; Coreno M.; Grazioli C.; Prince K.C.; Negri F.; Maris A., Chlorination and tautomerism: A computational and UPS/XPS study of 2-hydroxypyridine ⇌ 2-pyridone equilibrium, «PHYSICAL CHEMISTRY CHEMICAL PHYSICS», 2020, 22, pp. 13440 - 13455 [Scientific article]Open Access
Liu G.; Xiao C.; Negri F.; Li Y.; Wang Z., Dodecatwistarene Imides with Zigzag-Twisted Conformation for Organic Electronics, «ANGEWANDTE CHEMIE. INTERNATIONAL EDITION», 2020, 59, pp. 2008 - 2012 [Scientific article]Open Access
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., Insights into the mechanism of coreactant electrochemiluminescence facilitating enhanced bioanalytical performance, «NATURE COMMUNICATIONS», 2020, 11, Article number: 2668 , pp. 2668 - 2676 [Scientific article]Open Access
Salvitti G.; Negri F.; Perez-Jimenez A.J.; San-Fabian E.; Casanova D.; Sancho-Garcia J.C., Investigating the (Poly)Radicaloid Nature of Real-World Organic Compounds with DFT-Based Methods, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2020, 124, pp. 3590 - 3600 [Scientific article]Open Access
Canola, Sofia; Graham, Christina; Pérez-Jiménez, Ángel José; Sancho-García, Juan-Carlos; Negri, Fabrizia, Charge transport parameters for carbon based nanohoops and donor-acceptor derivatives, «PHYSICAL CHEMISTRY CHEMICAL PHYSICS», 2019, 21, pp. 2057-2068 - 2068 [Scientific article]Open Access
Medina Rivero, Samara; Canola, Sofia; Zeng, Wangdong; Ramírez, Francisco J; Zafra, José L; Wu, Jishan; Negri, Fabrizia; Casado, Juan, Long rylene nanoribbons express polyacetylene-like signatures at their edges, «PHYSICAL CHEMISTRY CHEMICAL PHYSICS», 2019, 21, pp. 7281-7287 - 7287 [Scientific article]
Canola S.; Mardegan L.; Bergamini G.; Villa M.; Acocella A.; Zangoli M.; Ravotto L.; Vinogradov S.A.; Di Maria F.; Ceroni P.; Negri F., One- and two-photon absorption properties of quadrupolar thiophene-based dyes with acceptors of varying strengths, «PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES», 2019, 18, pp. 2180 - 2190 [Scientific article]
