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Rights | Preview | Issue Date | Title | Author(s) | Type |
closedAccess |  | 2009 | A bond-bond description of the intermolecular interaction energy: The case of the weakly bound acetylene-hydrogen complex | Thibault, F.; Cappelletti, David; Pirani, Fernando; Bartolomei, Massimiliano CSIC ORCID | artículo |
closedAccess |  | 2008 | A bond-bond description of the intermolecular interaction energy: The case of weakly bound N2-H2 and N2-N2 complexes | Cappelletti, David; Pirani, Fernando; Bussery-Honvault, B.; Gomez, L.; Bartolomei, Massimiliano CSIC ORCID | artículo |
openAccess |  | 15-Apr-2019 | A combined experimental and theoretical investigation of Cs+ ions solvated in HeN clusters | Pérez de Tudela, Ricardo CSIC ORCID; Martini, Paul; Goulart, Marcelo; Scheier, Paul; Pirani, F.; Hernández-Rojas, Javier; Bretón, José; Ortiz de Zárate, J.; Bartolomei, Massimiliano CSIC ORCID ; González-Lezana, Tomás CSIC ORCID ; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID; Villarreal, Pablo CSIC ORCID | artículo |
openAccess | | 21-Feb-2019 | A cooperative multi-proton mechanism for proton permeation in graphene | Campos-Martínez, José CSIC ORCID; Hernández, Marta I. CSIC ORCID; Hernández-Lamoneda, Ramón; Bartolomei, Massimiliano CSIC ORCID | comunicación de congreso |
closedAccess |  | 2012 | A full dimensional grid empowered simulation of the CO 2 + CO 2 processes | Bartolomei, Massimiliano CSIC ORCID ; Pirani, Fernando; Laganà, Antonio; Lombardi, Andrea | artículo |
closedAccess |  | 20-Mar-2017 | A global optimization perspective on molecular clusters | Marques, J.M.C.; Pereira, F. B.; Llanio-Trujillo, J. L.; Abreu, P. E.; Albertí, M.; Aguilar, A.; Pirani, Fernando; Bartolomei, Massimiliano CSIC ORCID | artículo |
openAccess |  | 15-Jul-2019 | A multi-proton cooperative mechanism for graphene permeation of protons | Campos-Martínez, José CSIC ORCID; Hernández, Marta I. CSIC ORCID; Hernández-Lamoneda, Ramón; Bartolomei, Massimiliano CSIC ORCID | póster de congreso |
openAccess |  | 11-Jun-2019 | A new cooperative mechanism for the permeation of H/H+ through hydrogenated/protonated graphene | Bartolomei, Massimiliano CSIC ORCID ; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID; Hernández-Lamoneda, Ramón | póster de congreso |
openAccess |  | 2013 | A new method for the calculation of the interaction between atoms and small molecules and graphene-based surfaces | Bartolomei, Massimiliano CSIC ORCID ; Carmona-Novillo, Estela CSIC; Campos-Martínez, José CSIC ORCID; Pirani, Fernando | comunicación de congreso |
openAccess |  | 26-Sep-2016 | A novel nanoporous graphite based on graphynes: first-principles structure and carbon dioxide preferential physisorption | Bartolomei, Massimiliano CSIC ORCID ; Giorgi, Giacomo | artículo |
closedAccess |  | 4-May-2012 | A realistic potential to study oxygen dimers and oligomers | Carmona-Novillo, Estela CSIC; Bartolomei, Massimiliano CSIC ORCID ; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID | comunicación de congreso |
closedAccess |  | 2012 | Ab initio rovibrational structure of the lowest singlet state of O 2-O 2 | Carmona-Novillo, Estela CSIC; Bartolomei, Massimiliano CSIC ORCID ; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID; Hernández-Lamoneda, Ramón | artículo |
openAccess |  | 3-Jun-2008 | Accurate ab initio intermolecular potential energy surface for the quintet state of the O2(3Σ(-)(g))-O2((3)Σ(-)(g)) dimer | Bartolomei, Massimiliano CSIC ORCID ; Carmona-Novillo, Estela CSIC; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID; Hernández-Lamoneda, Ramón | artículo |
openAccess |  | 2013 | Accurate global potentials for the interaction between rare gases and graphene-based surfaces. A joint atom-bond and computational approach | Bartolomei, Massimiliano CSIC ORCID ; Carmona-Novillo, Estela CSIC; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID; Pirani, Fernando | póster de congreso |
openAccess | | 2013 | Accurate global potentials for the interaction between rare gases and graphene-based surfaces. A joint atom-bond and computational approach | Bartolomei, Massimiliano CSIC ORCID ; Carmona-Novillo, Estela CSIC; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID; Pirani, Fernando | comunicación de congreso |
openAccess | | 9-Oct-2014 | Accurate global potentials for the interaction between rare gases and graphene-based surfaces. Diffraction and quasibound states | Bartolomei, Massimiliano CSIC ORCID ; Carmona-Novillo, Estela CSIC; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID; Pirani, Fernando | póster de congreso |
openAccess |  | 5-Sep-2017 | Adsorption of molecular hydrogen on coronene with a new potential energy surface | Bartolomei, Massimiliano CSIC ORCID ; Pérez de Tudela, Ricardo CSIC ORCID; Arteaga, Kilian; González-Lezana, Tomás CSIC ORCID ; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID; Villarreal, Pablo CSIC ORCID; Hernández-Rojas, Javier; Bretón, José; Pirani, Fernando | artículo |
openAccess |  | 28-Jun-2019 | Aggregation enhancement of coronene molecules by seeding with alkali-metal ions | Bartolomei, Massimiliano CSIC ORCID ; Pirani, F.; Marques, J.M.C. | artículo |
openAccess |  | 14-Dec-2020 | Aggregation of coronene: The effect of carboxyl and amine functional groups | Correia, C.F.O.; Marques, J.M.C.; Bartolomei, Massimiliano CSIC ORCID ; Pirani, F.; Maçôas, E.; Martinho, J.M.G. | artículo |
openAccess |  | 11-May-2020 | An unrestricted approach for the accurate calculation of the interaction potentials of open-shell monomers: The case of O2–O2 | Valentín-Rodríguez, Mónica A.; Bartolomei, Massimiliano CSIC ORCID ; Hernández, Marta I. CSIC ORCID; Campos-Martínez, José CSIC ORCID; Hernández-Lamoneda, Ramón | artículo |