Sfoglia per Autore
Mostrati risultati da 1 a 11 di 11
Virtual reality tools for advanced modeling
2019 Lupi, Jacopo; Martino, Marta; Salvadori, A.; Rampino, S.; Mancini, G.; Barone, V.
The Quest for a Plausible Formation Route of Formyl Cyanide in the Interstellar Medium: A State-of-the-art Quantum-chemical and Kinetic Approach
2020 Tonolo, Francesca; Lupi, Jacopo; Puzzarini, Cristina; Barone, Vincenzo
A twist on the reaction of the CN radical with methylamine in the interstellar medium: New hints from a state-of-the-art quantum-chemical study
2020 Puzzarini, C.; Salta, Z.; Tasinato, N.; Lupi, J.; Cavallotti, C.; Barone, V.
The role of state-of-the-art quantum-chemical calculations in astrochemistry : formation route and spectroscopy of ethanimine as a paradigmatic case
2020 Baiano, C.; Lupi, J.; Tasinato, N.; Puzzarini, C.; Barone, V.
Unraveling the role of additional OH-radicals in the H–Abstraction from Dimethyl sulfide using quantum chemical computations
2020 Salta, Zoi; Lupi, Jacopo; Tasinato, Nicola; Barone, Vincenzo; Ventura, Oscar N.
Methanimine as a Key Precursor of Imines in the Interstellar Medium: The Case of Propargylimine
2020 Lupi, Jacopo; Puzzarini, Cristina; Barone, Vincenzo
H-Abstraction from Dimethyl Sulfide in the Presence of an Excess of Hydroxyl Radicals. A Quantum Chemical Evaluation of Thermochemical and Kinetic Parameters Unveils an Alternative Pathway to Dimethyl Sulfoxide
2020 Salta, Z.; Lupi, J.; Barone, V.; Ventura, O. N.
Exploring the Maze of C2N2H5 Radicals and Their Fragments in the Interstellar Medium with the Help of Quantum-Chemical Computations
2020 Salta, Zoi; Tasinato, Nicola; Lupi, Jacopo; Boussessi, Rahma; Balbi, Alice; Puzzarini, Cristina; Barone, Vincenzo
Development and Validation of a Parameter-Free Model Chemistry for the Computation of Reliable Reaction Rates
2021 Barone, V.; Lupi, J.; Salta, Z.; Tasinato, N.
Gliding on Ice in search of accurate and cost-effective computational methods for Astrochemistry on Grains: the puzzling case of the HCN isomerization
2022 Baiano, C.; Lupi, J.; Barone, V.; Tasinato, N.
Computational strategies for the accurate thermochemistry and kinetics of gas-phase reactions
2022 Lupi, Jacopo
Mostrati risultati da 1 a 11 di 11
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