GUIDO, Ciro Achille Statistiche

GUIDO, Ciro Achille  

DIPARTIMENTO DI CHIMICA E CHIMICA INDUSTRIALE  

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Risultati 1 - 13 di 13 (tempo di esecuzione: 0.021 secondi).
Titolo Data di pubblicazione Autore(i) File
A fully automated implementation of VPT2 Infrared intensities 1-gen-2010 Vincenzo, Barone; Julien, Bloino; Guido, Ciro Achille; Lipparini, Filippo
Benchmarking Time-Dependent Density Functional Theory for Excited State Geometries of Organic Molecules in Gas-Phase and in Solution 1-gen-2013 Guido, Ciro Achille; Stefan, Knecht; Jacob, Kongsted; Mennucci, Benedetta
Calorimetric investigation of the aggregation of lithium perfluorooctanoate on poly (ethyleneglycol) oligomers in water 1-gen-2006 Gianni, PAOLO ANGELO; Bernazzani, Luca; Guido, Ciro Achille; Mollica, Vincenzo
Circular Dichroism and TDDFT Investigation of Chiral Fluorinated Aryl Benzyl Sulfoxides 1-gen-2015 Berardozzi, Roberto; Guido, Ciro Achille; Capozzi, Maria Annunziata M.; Cardellicchio, Cosimo; DI BARI, Lorenzo; Pescitelli, Gennaro
Circularly Polarized Luminescence from Axially Chiral BODIPY DYEmers: An Experimental and Computational Study 1-gen-2016 Zinna, Francesco; Bruhn, Torsten; Guido, Ciro Achille; Ahrens, Johannes; Bröring, Martin; DI BARI, Lorenzo; Pescitelli, Gennaro
Communication: One third: A new recipe for the PBE0 paradigm 1-gen-2013 Guido, Ciro Achille; Eric, Brémond; Carlo, Adamo; Pietro, Cortona
Effective electron displacements: A tool for time-dependent density functional theory computational spectroscopy 1-gen-2014 Guido, Ciro Achille; Pietro, Cortona; Carlo, Adamo
On the Metric of Charge Transfer Molecular Excitations: A Simple Chemical Descriptor 1-gen-2013 Guido, Ciro Achille; Pietro, Cortona; Mennucci, Benedetta; Carlo, Adamo
On the TD-DFT Accuracy in Determining Single and Double Bonds in Excited-State Structures of Organic Molecules 1-gen-2010 Guido, Ciro Achille; D., Jacquemin; C., Adamo; Mennucci, Benedetta
Planar versus twisted intramolecular charge transfer mechanism in Nile Red: new hints from theory 1-gen-2010 Guido, Ciro Achille; Mennucci, Benedetta; D., Jacquemin; C., Adamo
Practical computation of electronic excitation in solution: vertical excitation model 1-gen-2011 Aleksandr V., Marenich; Christopher J., Cramer; Donald G., Truhlar; Guido, Ciro Achille; Mennucci, Benedetta; Giovanni, Scalmani; Michael J., Frisch
Structures and Properties of Electronically Excited Chromophores in Solution from the Polarizable Continuum Model Coupled to the Time-Dependent Density Functional Theory 1-gen-2009 Mennucci, Benedetta; Cappelli, Chiara; Guido, Ciro Achille; R., Cammi; J., Tomasi
The Fate of a Zwitterion in Water from Ab-Initio Molecular Dynamics: Monoethanolamine (MEA)-CO2 1-gen-2013 Guido, Ciro Achille; Fabio, Pietrucci; Gregoire A., Gallet; Wanda, Andreoni