TOFFOLI, DANIELE

TOFFOLI, DANIELE  

Dipartimento di Scienze Chimiche e Farmaceutiche  

Settore CHIM/02 - Chimica Fisica  

Docenti di ruolo di IIa fascia  

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Risultati 1 - 20 di 101 (tempo di esecuzione: 0.027 secondi).
Titolo Data di pubblicazione Autori File
3d Photoionization along the Xenon isoelectronic series 1-gen-2003 TOFFOLI, DANIELESTENER, MAURODECLEVA, PIETRO
A Multicentric Approach to the Calculation of Non dipolar Effects in Molecular Photoemission 1-gen-2008 TOFFOLI, DANIELEDECLEVA, PIETRO
Ab initio potential energy and dipole moment surfaces of the F -(H2O) complex 1-gen-2014 TOFFOLI, DANIELE +
Accurate multimode vibrational calculations using a B-spline basis: Theory, tests and application to dioxirane and diazirinone 1-gen-2011 TOFFOLI, DANIELE +
Active role of the support in NOx storage and reductioncatalytic systems 1-gen-2015 TOFFOLI, DANIELE +
An adaptive density-guided approach for the generation of potential energy surfaces of polyatomic molecules 1-gen-2009 TOFFOLI, DANIELE +
Angular dependent time delay near correlation induced Cooper minima 1-gen-2020 Toffoli D.Decleva P. +
Appearance of plasmons in fullerenes 1-gen-2012 Korica, SanjaFRONZONI, GIOVANNATOFFOLI, DANIELESTENER, MAURO +
Application of the Time-Dependent Density Functional Theory to the Photoionization of Xe 1-gen-2002 TOFFOLI, DANIELESTENER, MAURODECLEVA, PIETRO
Automatic generation of potential energy and property surfaces of polyatomic molecules in normal coordinates 1-gen-2007 TOFFOLI, DANIELE +
Bis(triisopropylsilylethynyl)pentacene/Au(111) interface: Coupling, molecular orientation, and thermal stability 1-gen-2014 TOFFOLI, DANIELELIZZIT, SILVANO +
Carbon and Nitrogen K-Edge NEXAFS Spectra of Indole, 2,3-Dihydro-7-azaindole, and 3-Formylindole 1-gen-2021 Ponzi, AuroraBernes, ElisaToffoli, DanieleFronzoni, GiovannaDi Fraia, Michele +
Chirality in bare and ligand-protected metal nanoclusters 1-gen-2018 Toffoli, DanieleStener, Mauro +
Circularly Polarized Plasmons in Chiral Gold Nanowires via Quantum-Mechanical Design 1-gen-2021 Toffoli, DanieleRussi, AndreaFronzoni, GiovannaCoccia, EmanueleStener, MauroFortunelli, Alessandro +
Combined effect of point defects and layer number on the adsorption of benzene and toluene on graphene 1-gen-2019 Toffoli D. +
Comparative Analysis of Reactant and Product Adsorption Energies in the Selective Oxidative Coupling of Alcohols to Esters on Au(111) 1-gen-2016 TOFFOLI, DANIELE +
Computational characterization of the HOMO-2 photoemission intensity oscillations in C60 1-gen-2011 TOFFOLI, DANIELESTENER, MAUROFRONZONI, GIOVANNADECLEVA, PIETRO
Computational NEXAFS Characterization of Molecular Model Systems for 2D Boroxine Frameworks 1-gen-2022 Toffoli, DanieleBernes, ElisaCossaro, AlbanoBalducci, GabrieleStener, MauroMauri, SilviaFronzoni, Giovanna
Continuum Electronic States: The Tiresia Code 1-gen-2022 Decleva P.Stener M.Toffoli D.
Convergence of the multicenter B-spline DFT approach for the continuum 1-gen-2002 TOFFOLI, DANIELESTENER, MAUROFRONZONI, GIOVANNADECLEVA, PIETRO