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Titolo Data di pubblicazione Autori Tipo File
High-Accuracy Vibrational Computations for Transition-Metal Complexes Including Anharmonic Corrections: Ferrocene, Ruthenocene, and Osmocene as Test Cases 2014 LATOUCHE, CAMILLEPALAZZETTI, FEDERICOSKOUTERIS, DimitriosBARONE, Vincenzo 1.1 Articolo in rivista
Accurate yet feasible computations of resonance Raman spectra for metal complexes in solution: [Ru(bpy)3]2+ as a case study 2014 Baiardi A.Latouche C.Bloino J.Barone V. 1.1 Articolo in rivista
CYANOMETHANIMINE ISOMERS IN COLD INTERSTELLAR CLOUDS: INSIGHTS FROM ELECTRONIC STRUCTURE AND KINETIC CALCULATIONS 2015 VAZART, FannyLATOUCHE, CAMILLESKOUTERIS, DimitriosBALUCANI, NadiaBARONE, Vincenzo 1.1 Articolo in rivista
Gas phase formation of the prebiotic molecule formamide: insights from new quantum computations 2015 BARONE, VincenzoLATOUCHE, CAMILLESKOUTERIS, DimitriosVAZART, FannyBALUCANI, Nadia + 1.1 Articolo in rivista
Toward the design of alkynylimidazole fluorophores: computational and experimental characterization of spectroscopic features in solution and in poly(methyl methacrylate) 2015 Barone V.Bellina F.Biczysko M.Bloino J.Fornaro T.Latouche C.Marianetti G.Minei P. + 1.1 Articolo in rivista
Vibronic coupling investigation to compute phosphorescence spectra of Pt(II) complexes 2015 Vazart F.Latouche C.Bloino J.Barone V. 1.1 Articolo in rivista
Implementation of a graphical user interface for the virtual multifrequency spectrometer: The VMS-Draw tool 2015 LICARI, DANIELEBAIARDI, ALBERTOBICZYSKO, MALGORZATA AGNIESZKAEGIDI, FRANCOLATOUCHE, CAMILLEBARONE, Vincenzo 1.1 Articolo in rivista
Reassessment of the Thermodynamic, Kinetic, and Spectroscopic Features of Cyanomethanimine Derivatives: A Full Anharmonic Perturbative Treatment 2015 VAZART, FannyCALDERINI, DANILOSKOUTERIS, DimitriosLATOUCHE, CAMILLEBARONE, Vincenzo 1.1 Articolo in rivista
Virtual eyes for technology and cultural heritage: towards computational strategy for new and old indigo-based dyes 2015 Barone, VincenzoBiczysko, MalgorzataLatouche, CamillePASTI, ANDREA 1.1 Articolo in rivista
TD-DFT Benchmark on Inorganic Pt(II) and Ir(III) Complexes 2015 LATOUCHE, CAMILLESKOUTERIS, DimitriosPALAZZETTI, FEDERICOBARONE, Vincenzo 1.1 Articolo in rivista
Anharmonic Computations Meet Experiments (IR, Raman, Neutron Diffraction) for Explaining the Behavior of 1,3,5-Tribromo-2,4,6-trimethylbenzene 2016 LATOUCHE, CAMILLEBOUCEKKINE, AbdouBARONE, Vincenzo + 1.1 Articolo in rivista
New insights into the vibrational and optical signatures of trans-stilbene via integrated experimental and quantum mechanical approaches 2016 LATOUCHE, CAMILLEBARONE, Vincenzo + 1.1 Articolo in rivista
Neutral copper(I) complexes featuring phosphinesulfonate chelates 2016 VAZART, FannyLATOUCHE, CAMILLEBARONE, Vincenzo + 1.1 Articolo in rivista
Encapsulating Iodine and Copper into Copper(I) Clusters Stabilized by Dichalcogenolate Ligands: Stability, Structure, and Optical Properties 2017 Latouche, CamilleBarone, Vincenzo + 1.1 Articolo in rivista
An: Ab initio study of Cu-based delafossites as an alternative to nickel oxide in photocathodes: Effects of Mg-doping and surface electronic features 2018 Latouche, CamilleBarone, VincenzoCRESCENZI, ORLANDOPAVONE, MICHELE + 1.1 Articolo in rivista
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