Sfoglia per SSD
Theoretical modeling of UV-Vis absorption and emission spectra in liquid state systems including vibrational and conformational effects: Explicit treatment of the vibronic transitions
2014-01-01 D'Abramo, M; Aschi, M; Amadei, A
Theoretical modeling of UV-Vis absorption and emission spectra in liquid state systems including vibrational and conformational effects: the vertical transition approximation
2013-09-01 D'Alessandro, M; Aschi, M; Mazzuca, C; Palleschi, A; Amadei, A
Theoretical modeling of vibroelectronic quantum states in complex molecular systems: Solvated carbon monoxide, a test case
2005-01-01 Amadei, A; Marinelli, F; D'Abramo, M; D'Alessandro, M; Anselmi, M; Di Nola, A; Aschi, M
Theoretical Models of Diastereomeric Noncovalent Electron-Transfer Reactions
1987-01-01 Pispisa, B; Palleschi, A; Paradossi, G
Theoretical prediction of thermodynamic equilibrium constants of chemical reactions in water
2007-01-01 D'Abramo, M; Aschi, M; Marinelli, F; Di Nola, A; Amadei, A
Theoretical study of intramolecular charge transfer in pi-conjugated oligomers
2007-01-01 Amadei, A; D'Abramo, M; Nola, A; Arcadi, A; Cerichelli, G; Aschi, M
Theoretical study of ionic liquids based on the cholinium cation: ab initio simulations of their condensed phases
2016-01-01 Campetella, M; Bodo, E; Montagna, M; De Santis, S; Gontrani, L
Theoretical-computational characterization of the temperature-dependent folding thermodynamics of a β-hairpin peptide
2016-01-01 Daidone, I; Zanetti-Polzi, L; Thukral, L; Alekozai, Em; Amadei, A
Theoretical-computational modeling of charge transfer and intersystem crossing reactions in complex chemical systems
2018-01-01 Amadei, A; Aschi, M
Theoretical-computational modeling of gas-state thermodynamics in flexible molecular systems: ionic liquids in the gas phase as a case study
2022-01-01 Amadei, A; Ciccioli, A; Filippi, A; Fraschetti, C; Aschi, M
Theoretical-computational modeling of infrared spectra in peptides and proteins: a new frontier for combined theoretical-experimental investigations
2010-01-01 Amadei, A; Daidone, I; Di Nola, A; Aschi, M
Theoretical-computational modeling of photo-induced charge separation spectrum and charge recombination kinetics in solution.
2014-01-01 Piacente, G; Amadei, A; D'Abramo, M; Daidone, I; Aschi, M
Theoretical-computational modelling of the L-alanine CD spectrum in water
2022-01-01 Chen, Cg; Giustini, M; Scipioni, A; Amadei, A; D'Abramo, M
Theoretical-computational modelling of the temperature dependence of the folding-unfolding thermodynamics and kinetics: The case of a trp-cage
2019-01-01 D'Abramo, M; Del Galdo, S; Amadei, A
Theoretical-computational modelling of the vibrational relaxation of small inorganic species in condensed phase
2022-01-01 Amadei, A; Aschi, M
Thermal and environmental effects on Oligothiophene low-energy singlet electronic excitations in dilute solution: a theoretical and experimental study
2012-01-01 Aschi, M; Amadei, A; Pellegrino, A; Perin, N; Po, R
Thermal and structural properties of ethylammonium chloride and its mixture with water
2011-01-01 Migliorati, V; Ballirano, P; Gontrani, L; Triolo, A; Caminiti, R
Thermal Properties, Raman Spectroscopy and TEM images of Neutron-Bombarded Graphite
2013-01-01 Cataldo, F; Ursini, O; Nasillo, G; Caponetti, E; Carbone, M; Valentini, F; Palleschi, G; Braung, T
Thermo-physical properties of ammonium-based ionic liquid + N-methyl-2-pyrrolidone mixtures at 298.15K
2014-01-01 Usula, M; Matteoli, E; Leonelli, F; Mocci, F; Marincola, Fc; Gontrani, L; Porcedda, S
Thermodynamic and kinetic characterization of a beta-hairpin peptide in solution: An extended phase space sampling by molecular dynamics simulations in explicit water
2005-01-01 Daidone, I; Amadei, A; Di Nola, A
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