Riccardo Spezia
机构: CNRS Research Director, Laboratoire de Chimie Théorique, Sorbonne Universités, Paris
主页: jussieu.fr
每年引用次数
引用次数
引用: 4,123
H-指数: 36
I10-指数 : 102
出版物: 231
Galactose-6-Sulfate collision induced dissociation using QM + MM chemical dynamics simulations and ESI-MS/MS experiments
Daniel Ortiz , Jean-Yves Salpin , Kihyung Song , Riccardo Spezia
International Journal of Mass Spectrometry 358 25 -35
20
2014
Computer simulation of collision induced dissociation and isolobal analogy: The case of biotin and its analogs
Yanghune Ha , Riccardo Spezia , Kihyung Song
International Journal of Mass Spectrometry 457 116417
2020
Collision-induced dissociation pathways of protonated Gly2NH2 and Gly3NH2 in the short time-scale limit by chemical dynamics and ion spectroscopy
Riccardo Spezia , Jonathan Martens , Jos Oomens , Kihyung Song
International Journal of Mass Spectrometry 388 40 -52
25
2015
Collision-induced dissociation mechanisms of protonated penta- and octa-glycine as revealed by chemical dynamics simulations
Riccardo Spezia , Soo Bok Lee , Ara Cho , Kihyung Song
International Journal of Mass Spectrometry 392 125 -138
17
2015
Gas phase fragmentation mechanisms of protonated testosterone as revealed by chemical dynamics simulations
Giae Lee , Eunkyung Park , Heesun Chung , Yannick Jeanvoine
International Journal of Mass Spectrometry 407 40 -50
6
2016
Unravelling the hydration structure of ThX4 (X = Br, Cl) water solutions by molecular dynamics simulations and X-ray absorption spectroscopy
Riccardo Spezia , Cesar Beuchat , Rodolphe Vuilleumier , Paola D’Angelo
Journal of Physical Chemistry B 116 ( 22) 6465 -6475
21
2012
Structure, Stability, and Electronic Properties of Dimethyl Sulfoxide and Dimethyl Formammide Clusters Containing Th(4.).
Maria Montagna , Yannick Jeanvoine , Riccardo Spezia , Enrico Bodo
Journal of Physical Chemistry A 120 ( 27) 4778 -4788
3
2016
Model Simulations of the Thermal Dissociation of the TIK(H+)2 Tripeptide: Mechanisms and Kinetic Parameters
Zahra Homayoon , Subha Pratihar , Edward Dratz , Ross Snider
Journal of Physical Chemistry A 120 ( 42) 8211 -8227
21
2016
Lutetium(iii) aqua ion: On the dynamical structure of the heaviest lanthanoid hydration complex
Francesco Sessa , Riccardo Spezia , Paola D’Angelo
Journal of Chemical Physics 144 ( 20) 204505 -204505
18
2016
A Coupled Car-Parrinello Molecular Dynamics and EXAFS Data Analysis Investigation of Aqueous Co2+
Riccardo Spezia , Magali Duvail , Pierre Vitorge , Thierry Cartailler
Journal of Physical Chemistry A 110 ( 48) 13081 -13088
36
2006
Conical intersections in solution : non-equilibrium versus equilibrium solvation
Riccardo Spezia , Irene Burghardt , James T. Hynes
Molecular Physics 104 ( 5) 903 -914
37
2006
p of silicic acid in presence of La3+ using single sweep method coupled to DFT-based molecular dynamics
Riccardo Spezia , Rodolphe Vuilleumier
Molecular Physics 111 3478 -3485
1
2013
Structure and stability of charged clusters
Mark A Miller , David A Bonhommeau , Christopher J Heard , Yuyoung Shin
arXiv: Soft Condensed Matter
5
2012
Molecular dynamics to rationalize EXAFS experiments : a dynamical model explaining hydration behaviour across the lanthanoid(III) series.
Riccardo Spezia , Magali Duvail , Pierre Vitorge , Paola D'Angelo
Journal of Physics: Conference Series 190 ( 1) 012056
10
2009
Degradation of LiTfO/TEGME and LiTfO/DME Electrolytes in Li-O2 Batteries
Marco Carboni , Andrea Giacomo Marrani , Riccardo Spezia , Sergio Brutti
Journal of The Electrochemical Society 165 ( 2) 118 -125
30
2018
l-Cysteine Modified by S-Sulfation: Consequence on Fragmentation Processes Elucidated by Tandem Mass Spectrometry and Chemical Dynamics Simulations.
Veronica Macaluso , Debora Scuderi , Maria Elisa Crestoni , Simonetta Fornarini
Journal of Physical Chemistry A 123 ( 17) 3685 -3696
9
2019
On the Use of Quantum Thermal Bath in Unimolecular Fragmentation Simulation.
Riccardo Spezia , Hichem Dammak
Journal of Physical Chemistry A 123 ( 40) 8542 -8551
4
2019
Extension of the perturbed matrix method: application to a water molecule
Riccardo Spezia , Massimiliano Aschi , Alfredo Di Nola , Andrea Amadei
Chemical Physics Letters 365 ( 5-6) 450 -456
39
2002
Threshold for shattering fragmentation in collision-induced dissociation of the doubly protonated tripeptide TIK(H+)2
Veronica Macaluso , Zahra Homayoon , Riccardo Spezia , William L. Hase
Physical Chemistry Chemical Physics 20 ( 30) 19744 -19749
7
2018
Assignment of IR bands of isolated and protein-bound Peridinin in its fundamental and triplet state by static FTIR, time-resolved step-scan FTIR and DFT calculations
Alberto Mezzetti , Elizabeth Kish , Bruno Robert , Riccardo Spezia
Journal of Molecular Structure 1090 58 -64
6
2015
Marie-Pierre Gaigeot, Professor Rodolphe Vuilleumier Magali Duvail Paola D'Angelo Jean-Yves Salpin Sergio Brutti Massimiliano Aschi alfredo di nola Ana Martín-Sómer Fausto Martelli Veronica Macaluso Estefania Rossich Molina Anne Boutin Emilio Martinez-Nunez Giovanni Chillemi Andrea Zitolo Leonardo Guidoni Christopher J. Cramer Enrico Bodo