RUINI, Alice

RUINI, Alice  

Dipartimento di Scienze Fisiche, Informatiche e Matematiche  

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Risultati 1 - 20 di 81 (tempo di esecuzione: 0.034 secondi).
Titolo Data di pubblicazione Autore(i) File
Ab initio complex band structure of conjugated polymers: Effects of hydrid density functional theory and GW schemes 1-gen-2012 A., Ferretti; G., Mallia; L., Martin Samos; G., Bussi; Ruini, Alice; B., Montanari; N. M., Harrison
Ab initio exploration of rearrangement reactions: Intramolecular hydrogen scrambling processes in acetone 1-gen-2006 CUCINOTTA C., S; Ruini, Alice; Catellani, A; Stirling, A.
Ab initio molecular dynamics study of the keto-enol tautomerism of acetone in solution 1-gen-2006 C. S., Cucinotta; Ruini, Alice; A., Catellani; A., Stirling
Ab initio optical absorption in conjugated polymers: the role of dimensionality, 1-gen-2004 Ruini, Alice
Ab Initio Simulation of Optical Limiting: The Case of Metal-Free Phthalocyanine 1-gen-2014 Cocchi, C; Prezzi, D; Ruini, Alice; Molinari, Elisa; Rozzi, Ca
Ab initio study of transport parameters in polymer crystals 1-gen-2004 Ferretti, A; Ruini, Alice; Bussi, G; Molinari, Elisa; Caldas, Mj
Ab-initio study of chemisorption reactions for carboxylic acids on hydrogenated silicon surfaces 1-gen-2004 C. S., Cucinotta; Ruini, Alice; Molinari, Elisa; M. J., Caldas
Ab-initio study of Coulomb-correlated optical properties in conjugated polymers 1-gen-2001 Ruini, Alice; F., Rossi; U., Hohenester; Molinari, Elisa; R., Capaz; M. J., Caldas
Ab-initio study of excitonic effects in conventional and organic semiconductors 1-gen-2005 Hummer, K; Ambrosch Draxl, C; Bussi, G; Ruini, Alice; Caldas, Mj; Molinari, Elisa; Laskowski, R; Christensen, Ne
Accurate ab initio tight-binding Hamiltonians: Effective tools for electronic transport and optical spectroscopy from first principles 1-gen-2016 D'Amico, Pino; Agapito, Luis; Catellani, Alessandra; Ruini, Alice; Curtarolo, Stefano; Fornari, Marco; Nardelli, Marco Buongiorno; Calzolari, Arrigo
Anchor Group versus Conjugation: Toward the Gap-State Engineering of Functionalized ZnO(10(1)over-bar0) Surface for Optoelectronic Applications 1-gen-2011 A., Calzolari; Ruini, Alice; A., Catellani
Anisotropy and Size Effects on the Optical Spectra of Polycyclic Aromatic Hydrocarbons 1-gen-2014 Cocchi, Caterina; Prezzi, Deborah; Ruini, Alice; Caldas, Marilia J; Molinari, Elisa
Band structure modulation by methoxy-functionalization of graphene nanoribbons 1-gen-2022 Götz, Alicia; Wang, Xiao-Ye; Ruini, Alice; Zheng, Wenhao; Soltani, Paniz; Graf, Robert; Tries, Alexander; Li, Juan; Palma, Carlos-Andres; Molinari, Elisa; Hansen, Michael Ryan; Wang, Hai I.; Prezzi, Deborah; Müllen, Klaus; Narita, Akimitsu
Bandgap Engineering of Graphene Nanoribbons by Control over Structural Distortion 1-gen-2018 Hu, Yunbin; Xie, Peng; DE CORATO, Marzio; Ruini, Alice; Zhao, Shen; Meggendorfer, Felix; Straasø, Lasse Arnt; Rondin, Loic; Simon, Patrick; Li, Juan; Finley, Jonathan J.; Hansen, Michael Ryan; Lauret, Jean-Sébastien; Molinari, Elisa; Feng, Xinliang; Barth, Johannes V.; Palma, Carlos-Andres; Prezzi, Deborah; Müllen, Klaus; Narita, Akimitsu
Charge Separation in the Hybrid CdSe Nanocrystal–Organic Interface: Role of the Ligands Studied by Ultrafast Spectroscopy and Density Functional Theory 1-gen-2013 Tersilla, Virgili; Arrigo, Calzolari; Inmaculada Suárez, López; Barbara, Vercelli; Gianni, Zotti; Alessandra, Catellani; Ruini, Alice; Francesco, Tassone
Charge transport and radiative recombination in polythiophene crystals: a first-principles study 1-gen-2003 Ruini, A.; Bussi, G.; Ferretti, A.; Caldas, M. J.; Molinari, E.
Competitive chemisorption of bifunctional carboxylic acids on H : Si(100): A first-principles study 1-gen-2008 CUCINOTTA C., S; Ruini, Alice; Molinari, Elisa; PIGNEDOLI C., A; Catellani, A; Caldas, M. J.
Concavity Effects on the Optical Properties of Aromatic Hydrocarbons 1-gen-2013 Caterina, Cocchi; Deborah, Prezzi; Ruini, Alice; Marilia J., Caldas; Annalisa, Fasolino; Molinari, Elisa
Conflicting effect of chemical doping on the thermoelectric response of ordered PEDOT aggregates 1-gen-2018 Cigarini, Luigi; Ruini, Alice; Catellani, Alessandra; Calzolari, Arrigo
Defect-induced effects on carrier migration through one-dimensional poly(para-phenylenevinylene) chains 1-gen-2008 Zoppi, L; Calzolari, A; Ruini, Alice; Ferretti, A; Caldas, M. J.