검색결과 : 31건
| No. | Article |
|---|---|
| 1 |
L-Cysteine Modified by S-Sulfation: Consequence on Fragmentation Processes Elucidated by Tandem Mass Spectrometry and Chemical Dynamics Simulations Macaluso V, Scuderi D, Crestoni ME, Fornarini S, Corinti D, Dalloz E, Martinez-Nunez E, Hase WL, Spezia R Journal of Physical Chemistry A, 123(17), 3685, 2019 |
| 2 |
On the Use of Quantum Thermal Bath in Unimolecular Fragmentation Simulation Spezia R, Dammak H Journal of Physical Chemistry A, 123(40), 8542, 2019 |
| 3 |
Unimolecular Fragmentation of Deprotonated Diproline [Pro(2)-H](-) Studied by Chemical Dynamics Simulations and IRMPD Spectroscopy Martin-Somer A, Martens J, Grzetic J, Hase WL, Oomens J, Spezia R Journal of Physical Chemistry A, 122(10), 2612, 2018 |
| 4 |
Gas Phase Synthesis of Protonated Glycine by Chemical Dynamics Simulations Jeanvoine Y, Largo A, Hase WL, Spezia R Journal of Physical Chemistry A, 122(3), 869, 2018 |
| 5 |
Degradation of LiTfO/TEGME and LiTfO/DME Electrolytes in Li-O-2 Batteries Carboni M, Marrani AG, Spezia R, Brutti S Journal of the Electrochemical Society, 165(2), A118, 2018 |
| 6 |
Solvation Properties of the Actinide Ion Th(IV) in DMSO and DMSO:Water Mixtures through Polarizable Molecular Dynamics Montagna M, Spezia R, Bodo E Inorganic Chemistry, 56(19), 11929, 2017 |
| 7 |
Structure, Stability, and Electronic Properties of Dimethyl Sulfoxide and Dimethyl Formammide Clusters Containing Th4+ Montagna M, Jeanvoine Y, Spezia R, Bodo E Journal of Physical Chemistry A, 120(27), 4778, 2016 |
| 8 |
Model Simulations of the Thermal Dissociation of the TIK(H+)(2) Tripeptide: Mechanisms and Kinetic Parameters Homayoon Z, Pratihar S, Dratz E, Snider R, Spezia R, Barnes GL, Macaluso V, Somer AM, Hase WL Journal of Physical Chemistry A, 120(42), 8211, 2016 |
| 9 |
Solvent Structure around Lanthanoid(III) Ions in Liquid DMSO As Revealed by Polarizable Molecular Dynamics Simulations Bodo E, Macaluso V, Spezia R Journal of Physical Chemistry B, 119(42), 13347, 2015 |
| 10 |
Unimolecular Fragmentation Induced By Low-Energy Collision: Statistically or Dynamically Driven? Martin-Somer A, Yanez M, Gaigeot MP, Spezia R Journal of Physical Chemistry A, 118(46), 10882, 2014 |