DI FELICE, ROSA
DI FELICE, ROSA
Istituto Nanoscienze - NANO
A density functional theory study of cytosine on Au(111)
2012 Rosa M; Corni S; Di Felice; R
A Perspective on Sustainable Computational Chemistry Software Development and Integration
2023 DI FELICE, Rosa; Mayes Maricris, L; Richard Ryan, M; WilliamsYoung David, B; Chan Garnet, Kinlic; de Jong Wibe, A; Govind, Niranjan; Headgordon, Martin; Hermes Matthew, R; Kowalski, Karol; Li, Xiaosong; Lischka HansMueller Karl, T; Mutlu, Erdal; Niklasson Anders, M N; Pederson Mark, R; Peng, Bo; Shepard, Ron; Valeev Edward, F; van Schilfgaarde, Mark; Vlaisavljevich, Bess; Windus Theresa, L; Xantheas Sotiris Sj, M; Zhang, Xing; Zimmerman Paul, M
A TDDFT study of the excited states of DNA bases and their assemblies
2006 Varsano, D; Di Felice, R; Marques, MAL; Rubio, A
Ab initio investigation of the adsorption of organic molecules at Si(111) and Si(100) surfaces
2003 Di Felice R.; Pignedoli C.A.; Bertoni C.M.; Catellani A.; Silvestrelli P.L.; Sbraccia C.; Ancilotto F.; Palummo M.; Pulci O.
Ab initio optical absorption spectra of size-expanded xDNA base assemblies
2007 Varsano, D; Garbesi, A; Di Felice, R
Ab initio simulation of complex hybrid systems
2008 Calzolari A.; Corni S.; Di Felice R.; Cicero G.; Catellani A.
Ab initio simulation of SiC growth
2004 Righi, Mc; Pignedoli, Ac; Di Felice, R; Bertoni, Cm; Catellani, A
Ab initio simulations of Protein Surface Interactions mediated by Water
2007 Calzolari, A; Corni, S; di Felice, R; Cicero, G; Catellani, A
Ab initio simulations of protein surface interactions mediated by water
2008 Calzolari, A; Corni, S; Di Felice, R; Cicero, G; Catellani, A
Ab initio simulations of protein surface interactions mediated by water
2008 Calzolari, A; Corni, S; Di Felice, R; Cicero, G; Catellani, A
Ab initio study of model guanine assemblies: The role of pi-pi coupling and band transport
2002 DI FELICE, Rosa; Calzolari, A; Molinari, E; Garbesi, A
Ab initio study of the EFG at the N sites in imidazole
2008 Goncalves, Mb; Di Felice, R; Poleshchuk, Ok; Petrilli, Hm
Ab-initio simulations of SiC homoepitaxial growth
2003 Righi, Mc; Pignedoli, Ca; Di Felice, R; Bertoni, Cm; Catellani, A
Ab-initio simulations of SiC homoepitaxial growth
2003 Righi, Mc; Pignedoli, Ca; Di Felice, R; Bertoni, Cm; Catellani, A
Absorption Properties of Metal-Semiconductor Hybrid Nanoparticles
2011 Shaviv, Ehud; Schubert, Olaf; Alvessantos, Marcelo; Goldoni, Guido; DI FELICE, Rosa; Vallee, Fabrice; Del Fatti, Natalia; Banin, Uri; Soennichsen, Carsten
Absorption Properties of Metal-Semiconductor Hybrid Nanoparticles
2011 Shaviv E.; O. Schubert; M. AlvesSantos; G. Goldoni; R. Di Felice; F. Vallee; N. Del Fatti; U. Banin
Acetylene on Si(111) from computer simulations
2005 Sbraccia C.; Pignedoli C.A.; Catellani A.; Di Felice R.; Silvestrelli P.L.; Toigo F.; Ancilotto F.; Bertoni C.M.
Achieving a quantum smart workforce
2021 Aiello, Clarice D; Awschalom, D D; Bernien, Hannes; Brower, Tina; Brown, Kenneth R; Brun, Todd A; Caram, Justin R; Chitambar, Eric; Di Felice, Rosa; Edmonds, Karina Montilla; Fox, Michael F J; Haas, Stephan; Holleitner, Alexander W; Hudson, Eric R; Hunt, Jeffrey H; Joynt, Robert; Koziol, Scott; Larsen, M; Lewandowski, H J; Mcclure, Doug T; Palsberg, Jens; Passante, Gina; Pudenz, Kristen L; Richardson, Christopher J K; Rosenberg, Jessica L; Ross, R S; Saffman, Mark; Singh, M; Steuerman, David W; Stark, Chad; Thijssen, Jos; Vamivakas, A Nick; Whitfield, James D; Zwickl, Benjamin M
Adsorption Mechanisms of Nucleobases on the Hydrated Au(111) Surface
2018 Rosa, Marta; Di Felice, Rosa; Corni, Stefano
Adsorption modes of cysteine on Au(111): Thiolate, amino-thiolate, disulfide
2004 Di Felice, R.; Selloni, A.
Titolo | Data di pubblicazione | Autore(i) | File |
---|---|---|---|
A density functional theory study of cytosine on Au(111) | 1-gen-2012 | Rosa M; Corni S; Di Felice; R | |
A Perspective on Sustainable Computational Chemistry Software Development and Integration | 1-gen-2023 | DI FELICE, Rosa; Mayes Maricris, L; Richard Ryan, M; WilliamsYoung David, B; Chan Garnet, Kinlic; de Jong Wibe, A; Govind, Niranjan; Headgordon, Martin; Hermes Matthew, R; Kowalski, Karol; Li, Xiaosong; Lischka HansMueller Karl, T; Mutlu, Erdal; Niklasson Anders, M N; Pederson Mark, R; Peng, Bo; Shepard, Ron; Valeev Edward, F; van Schilfgaarde, Mark; Vlaisavljevich, Bess; Windus Theresa, L; Xantheas Sotiris Sj, M; Zhang, Xing; Zimmerman Paul, M | |
A TDDFT study of the excited states of DNA bases and their assemblies | 1-gen-2006 | Varsano, D; Di Felice, R; Marques, MAL; Rubio, A | |
Ab initio investigation of the adsorption of organic molecules at Si(111) and Si(100) surfaces | 1-gen-2003 | Di Felice R.; Pignedoli C.A.; Bertoni C.M.; Catellani A.; Silvestrelli P.L.; Sbraccia C.; Ancilotto F.; Palummo M.; Pulci O. | |
Ab initio optical absorption spectra of size-expanded xDNA base assemblies | 1-gen-2007 | Varsano, D; Garbesi, A; Di Felice, R | |
Ab initio simulation of complex hybrid systems | 1-gen-2008 | Calzolari A.; Corni S.; Di Felice R.; Cicero G.; Catellani A. | |
Ab initio simulation of SiC growth | 1-gen-2004 | Righi, Mc; Pignedoli, Ac; Di Felice, R; Bertoni, Cm; Catellani, A | |
Ab initio simulations of Protein Surface Interactions mediated by Water | 1-gen-2007 | Calzolari, A; Corni, S; di Felice, R; Cicero, G; Catellani, A | |
Ab initio simulations of protein surface interactions mediated by water | 1-gen-2008 | Calzolari, A; Corni, S; Di Felice, R; Cicero, G; Catellani, A | |
Ab initio simulations of protein surface interactions mediated by water | 1-gen-2008 | Calzolari, A; Corni, S; Di Felice, R; Cicero, G; Catellani, A | |
Ab initio study of model guanine assemblies: The role of pi-pi coupling and band transport | 1-gen-2002 | DI FELICE, Rosa; Calzolari, A; Molinari, E; Garbesi, A | |
Ab initio study of the EFG at the N sites in imidazole | 1-gen-2008 | Goncalves, Mb; Di Felice, R; Poleshchuk, Ok; Petrilli, Hm | |
Ab-initio simulations of SiC homoepitaxial growth | 1-gen-2003 | Righi, Mc; Pignedoli, Ca; Di Felice, R; Bertoni, Cm; Catellani, A | |
Ab-initio simulations of SiC homoepitaxial growth | 1-gen-2003 | Righi, Mc; Pignedoli, Ca; Di Felice, R; Bertoni, Cm; Catellani, A | |
Absorption Properties of Metal-Semiconductor Hybrid Nanoparticles | 1-gen-2011 | Shaviv, Ehud; Schubert, Olaf; Alvessantos, Marcelo; Goldoni, Guido; DI FELICE, Rosa; Vallee, Fabrice; Del Fatti, Natalia; Banin, Uri; Soennichsen, Carsten | |
Absorption Properties of Metal-Semiconductor Hybrid Nanoparticles | 1-gen-2011 | Shaviv E.; O. Schubert; M. AlvesSantos; G. Goldoni; R. Di Felice; F. Vallee; N. Del Fatti; U. Banin | |
Acetylene on Si(111) from computer simulations | 1-gen-2005 | Sbraccia C.; Pignedoli C.A.; Catellani A.; Di Felice R.; Silvestrelli P.L.; Toigo F.; Ancilotto F.; Bertoni C.M. | |
Achieving a quantum smart workforce | 1-gen-2021 | Aiello, Clarice D; Awschalom, D D; Bernien, Hannes; Brower, Tina; Brown, Kenneth R; Brun, Todd A; Caram, Justin R; Chitambar, Eric; Di Felice, Rosa; Edmonds, Karina Montilla; Fox, Michael F J; Haas, Stephan; Holleitner, Alexander W; Hudson, Eric R; Hunt, Jeffrey H; Joynt, Robert; Koziol, Scott; Larsen, M; Lewandowski, H J; Mcclure, Doug T; Palsberg, Jens; Passante, Gina; Pudenz, Kristen L; Richardson, Christopher J K; Rosenberg, Jessica L; Ross, R S; Saffman, Mark; Singh, M; Steuerman, David W; Stark, Chad; Thijssen, Jos; Vamivakas, A Nick; Whitfield, James D; Zwickl, Benjamin M | |
Adsorption Mechanisms of Nucleobases on the Hydrated Au(111) Surface | 1-gen-2018 | Rosa, Marta; Di Felice, Rosa; Corni, Stefano | |
Adsorption modes of cysteine on Au(111): Thiolate, amino-thiolate, disulfide | 1-gen-2004 | Di Felice, R.; Selloni, A. |