SELLI, DANIELE

SELLI, DANIELE  

DIPARTIMENTO DI SCIENZA DEI MATERIALI  

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Risultati 1 - 20 di 27 (tempo di esecuzione: 0.01 secondi).
Titolo Tipologia Data di pubblicazione Autori File
Computational Electrochemistry of Water Oxidation on Metal-Doped and Metal-Supported Defective h-BN 02 - Intervento a convegno 2019 Perilli, D.Selli, D.Liu, H.Di Valentin, C.
Impact of surface curvature, grafting density and solvent type on the PEGylation of titanium dioxide nanoparticles 01 - Articolo su rivista 2019 Selli, DMotta, SDi Valentin, C
Unraveling Dynamical and Light Effects on Functionalized Titanium Dioxide Nanoparticles for Bioconjugation 01 - Articolo su rivista 2019 Costanza RonchiMartina DatteoMoloud KavianiDaniele SelliCristiana Di Valentin
Computational Electrochemistry of Water Oxidation on Metal-Doped and Metal-Supported Defective h-BN 01 - Articolo su rivista 2019 Perilli, DSelli, DLiu, HDi Valentin, C
Proton Transfers at a Dopamine-Functionalized TiO 2 Interface 01 - Articolo su rivista 2019 Ronchi, CSelli, DDi Valentin, C +
Optimizing PEGylation of TiO2 Nanocrystals through a Combined Experimental and Computational Study 01 - Articolo su rivista 2019 Selli, DTawfilas, MMauri, MSimonutti, RDi Valentin, C
Water at the Interface Between Defective Graphene and Cu or Pt (111) Surface 02 - Intervento a convegno 2018 Perilli, DFerrighi, LSelli, DDi Valentin, C
Modelling Realistic TiO2 Nanoparticles, Their Photoactivation and Interaction with Water 02 - Intervento a convegno 2018 Di Valentin, CSelli, DKAVIANI BAGHBADORANI, MOLOUDLiu, HDatteo, MRonchi, C
Modelling Realistic TiO2 Nanoparticles, Their Photoactivation and Interaction with Water 02 - Intervento a convegno 2018 Di Valentin, CFazio, GSelli, D +
Quantum chemical simulations of stimuli-responsive nanomaterials for biomedical applications 02 - Intervento a convegno 2018 Di Valentin, CSelli, DKaviani, M
h-BN Defective Layers as Giant N-Donor Macrocycles for Cu Adatom Trapping from the Underlying Metal Substrate 01 - Articolo su rivista 2018 PERILLI, DANIELESELLI, DANIELELIU, HONGSHENGEnrico BianchettiCristiana Di Valentin
Water-Assisted Hole Trapping at the Highly Curved Surface of Nano-TiO2Photocatalyst 01 - Articolo su rivista 2018 Fazio, GianlucaSelli, DanieleFerraro, LorenzoDi Valentin, Cristiana +
Curved TiO2 Nanoparticles in Water: Short (Chemical) and Long (Physical) Range Interfacial Effects 01 - Articolo su rivista 2018 Fazio, GianlucaSelli, DanieleFerraro, LorenzoDi Valentin, Cristiana +
Interfacing CRYSTAL/AMBER to optimize QM/MM Lennard–Jones parameters for water and to study solvation of TiO2 nanoparticles 01 - Articolo su rivista 2018 Selli, DFazio, GFerraro, LDi Valentin, C +
Quantum chemical simulation of nanostructured materials: 2D sheets and 0D nanoparticles 02 - Intervento a convegno 2017 Di Valentin, CFERRIGHI, LDATTEO, MFAZIO, GSELLI, D
Quantum chemical simulation of nanostructured materials: 2D sheets and 0D nanoparticles 02 - Intervento a convegno 2017 Di Valentin, CFerrighi, LDatteo, MFazio, GSelli, D
Interfaces: Modeling and computational strategies 02 - Intervento a convegno 2017 Selli, DFazio, G.Ferrighi, LPerilli, DDi Valentin, C +
Using Density Functional Theory to Model Realistic TiO2 Nanoparticles, Their Photoactivation and Interaction with Water 01 - Articolo su rivista 2017 Selli, DanieleFazio, GianlucaDi Valentin, Cristiana
Water Multilayers on TiO2 (101) Anatase Surface: Assessment of a DFTB-Based Method 01 - Articolo su rivista 2017 SELLI, DANIELEFAZIO, GIANLUCADI VALENTIN, CRISTIANA +
Modelling realistic TiO2 nanospheres: A benchmark study of SCC-DFTB against hybrid DFT 01 - Articolo su rivista 2017 Selli, DanieleFazio, GianlucaDi Valentin, Cristiana