검색결과 : 13건
No. | Article |
---|---|
1 |
Characterization of the Photochemical Properties of 5-Benzyluracil via Time-Dependent Density Functional Theory Micciarelli M, Curchod BFE, Bonella S, Altucci C, Valadan M, Rothlisberger U, Tavernelli I Journal of Physical Chemistry A, 121(20), 3909, 2017 |
2 |
Thermal Diffusion in Binary Mixtures: Transient Behavior and Transport Coefficients from Equilibrium and Nonequilibrium Molecular Dynamics Bonella S, Ferrario M, Ciccotti G Langmuir, 33(42), 11281, 2017 |
3 |
Probabilistic Derivation of Spatiotemporal Correlation Functions in the Hydrodynamic Limit Ciccotti G, Bonella S, Ferrario M, Pierleoni C Journal of Physical Chemistry B, 120(8), 1996, 2016 |
4 |
Photophysics and Photochemistry of a DNA-Protein Cross-Linking Model: A Synergistic Approach Combining Experiments and Theory Micciarelli M, Valadan M, Della Ventura B, Di Fabio G, De Napoli L, Bonella S, Rothlisberger U, Tavernelli I, Altucci C, Velotta R Journal of Physical Chemistry B, 118(19), 4983, 2014 |
5 |
Mapping the Hydropathy of Amino Acids Based on Their Local Solvation Structure Bonella S, Raimondo D, Milanetti E, Tramontano A, Ciccotti G Journal of Physical Chemistry B, 118(24), 6604, 2014 |
6 |
Linearization approximations and Liouville quantum-classical dynamics Bonella S, Ciccotti G, Kapral R Chemical Physics Letters, 484(4-6), 399, 2010 |
7 |
Hydration Structure of the Quaternary Ammonium Cations Babiaczyk WI, Bonella S, Guidoni L, Ciccotti G Journal of Physical Chemistry B, 114(46), 15018, 2010 |
8 |
An adiabatic linearized path integral approach for quantum time-correlation functions II: A cumulant expansion method for improving convergence Causo MS, Ciccotti G, Bonella S, Vuilleumier R Journal of Physical Chemistry B, 110(32), 16026, 2006 |
9 |
Trajectory study of supercollision relaxation in highly vibrationally excited pyrazine and CO2 Li ZM, Sansom R, Bonella S, Coker DF, Mullin AS Journal of Physical Chemistry A, 109(34), 7657, 2005 |
10 |
An adiabatic linearized path integral approach for quantum time functions: Electronic transport in metal-molten salt solutions Causo MS, Ciccotti G, Montemayor D, Bonella S, Coker DF Journal of Physical Chemistry B, 109(14), 6855, 2005 |