RUINI, Alice
RUINI, Alice
Dipartimento di Scienze Fisiche, Informatiche e Matematiche
A first-principles study of self-healing binders for next-generation Si-based lithium-ion batteries
2023 Maji, R.; Salvador, M. A.; Ruini, A.; Magri, R.; Degoli, E.
A symmetrized-basis approach to excitons in carbon nanotubes
2005 G., Bussi; E., Chang; Ruini, Alice; Molinari, Elisa
Ab initio complex band structure of conjugated polymers: Effects of hydrid density functional theory and GW schemes
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
2006 CUCINOTTA C., S; Ruini, Alice; Catellani, A; Stirling, A.
Ab initio molecular dynamics study of the keto-enol tautomerism of acetone in solution
2006 C. S., Cucinotta; Ruini, Alice; A., Catellani; A., Stirling
Ab initio optical absorption in conjugated polymers: the role of dimensionality,
2004 Ruini, Alice
Ab Initio Simulation of Optical Limiting: The Case of Metal-Free Phthalocyanine
2014 Cocchi, C; Prezzi, D; Ruini, Alice; Molinari, Elisa; Rozzi, Ca
Ab initio study of transport parameters in polymer crystals
2004 Ferretti, A; Ruini, Alice; Bussi, G; Molinari, Elisa; Caldas, Mj
Ab-initio study of chemisorption reactions for carboxylic acids on hydrogenated silicon surfaces
2004 C. S., Cucinotta; Ruini, Alice; Molinari, Elisa; M. J., Caldas
Ab-initio study of Coulomb-correlated optical properties in conjugated polymers
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
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
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
2011 A., Calzolari; Ruini, Alice; A., Catellani
Anisotropy and Size Effects on the Optical Spectra of Polycyclic Aromatic Hydrocarbons
2014 Cocchi, Caterina; Prezzi, Deborah; Ruini, Alice; Caldas, Marilia J; Molinari, Elisa
Band structure modulation by methoxy-functionalization of graphene nanoribbons
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
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
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
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
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
2013 Caterina, Cocchi; Deborah, Prezzi; Ruini, Alice; Marilia J., Caldas; Annalisa, Fasolino; Molinari, Elisa
Titolo | Data di pubblicazione | Autore(i) | File |
---|---|---|---|
A first-principles study of self-healing binders for next-generation Si-based lithium-ion batteries | 1-gen-2023 | Maji, R.; Salvador, M. A.; Ruini, A.; Magri, R.; Degoli, E. | |
A symmetrized-basis approach to excitons in carbon nanotubes | 1-gen-2005 | G., Bussi; E., Chang; Ruini, Alice; Molinari, Elisa | |
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 |