Artikler med mandater om offentlig tilgang - Giovanni CiccottiLes mer
Ikke tilgjengelige noe sted: 9
Mechanisms and nucleation rate of methane hydrate by dynamical nonequilibrium molecular dynamics
M Lauricella, G Ciccotti, NJ English, B Peters, S Meloni
The Journal of Physical Chemistry C 121 (43), 24223-24234, 2017
Mandater: Science Foundation Ireland, Government of Italy
Thermal diffusion in binary mixtures: Transient behavior and transport coefficients from equilibrium and nonequilibrium molecular dynamics
S Bonella, M Ferrario, G Ciccotti
Langmuir 33 (42), 11281-11290, 2017
Mandater: Government of Italy
Quantum trajectories for the dynamics in the exact factorization framework: A proof-of-principle test
F Talotta, F Agostini, G Ciccotti
The Journal of Physical Chemistry A 124 (34), 6764-6777, 2020
Mandater: Agence Nationale de la Recherche
Quantum dynamical structure factor of liquid neon via a quasiclassical symmetrized method
M Monteferrante, S Bonella, G Ciccotti
The Journal of chemical physics 138 (5), 2013
Mandater: Science Foundation Ireland
Equilibrium and Rate Constants, and Reaction Mechanism of the HF Dissociation in the HF(H2O)7 Cluster by ab Initio Rare Event Simulations
AM Elena, S Meloni, G Ciccotti
The Journal of Physical Chemistry A 117 (49), 13039-13050, 2013
Mandater: Science Foundation Ireland, European Commission
Electroless formation of silver nanoaggregates: an experimental and molecular dynamics approach
F Gentile, M Monteferrante, L Chiodo, A Toma, ML Coluccio, G Ciccotti, ...
Molecular Physics 112 (9-10), 1375-1388, 2014
Mandater: Science Foundation Ireland, Government of Italy
Gas phase infrared spectra via the phase integration quasi-classical method
J Beutier, M Monteferrante, S Bonella, R Vuilleumier, G Ciccotti
Molecular Simulation 40 (1-3), 196-207, 2014
Mandater: Science Foundation Ireland, Government of Italy
Short range hydrogen diffusion in Na 3 AlH 6
M Monteferrante, S Bonella, G Ciccotti
Physical Chemistry Chemical Physics 13 (22), 10546-10555, 2011
Mandater: Science Foundation Ireland
Gas phase infrared spectra from quasi-classical Kubo time correlation functions
J Beutier, R Vuilleumier, S Bonella, G Ciccotti
Molecular Physics 113 (17-18), 2894-2904, 2015
Mandater: Science Foundation Ireland
Tilgjengelige et eller annet sted: 45
On the assumptions underlying milestoning
E Vanden-Eijnden, M Venturoli, G Ciccotti, R Elber
The Journal of chemical physics 129 (17), 2008
Mandater: US National Institutes of Health
Adaptive resolution molecular dynamics simulation through coupling<? format?> to an internal particle reservoir
S Fritsch, S Poblete, C Junghans, G Ciccotti, L Delle Site, K Kremer
Physical review letters 108 (17), 170602, 2012
Mandater: Science Foundation Ireland
Methane clathrate hydrate nucleation mechanism by advanced molecular simulations
M Lauricella, S Meloni, NJ English, B Peters, G Ciccotti
The Journal of Physical Chemistry C 118 (40), 22847-22857, 2014
Mandater: Science Foundation Ireland, Government of Italy
Molecular simulations: past, present, and future (a Topical Issue in EPJB)
G Ciccotti, C Dellago, M Ferrario, ER Hernández, ME Tuckerman
The European Physical Journal B 95 (1), 3, 2022
Mandater: Government of Spain
Theory and methods for rare events
S Bonella, S Meloni, G Ciccotti
The European Physical Journal B 85, 1-19, 2012
Mandater: Science Foundation Ireland
Clathrate structure-type recognition: Application to hydrate nucleation and crystallisation
M Lauricella, S Meloni, S Liang, NJ English, PG Kusalik, G Ciccotti
The Journal of chemical physics 142 (24), 2015
Mandater: Natural Sciences and Engineering Research Council of Canada, National …
Hydration structure of the quaternary ammonium cations
WI Babiaczyk, S Bonella, L Guidoni, G Ciccotti
The Journal of Physical Chemistry B 114 (46), 15018-15028, 2010
Mandater: Science Foundation Ireland
Temperature accelerated Monte Carlo (TAMC): a method for sampling the free energy surface of non-analytical collective variables
G Ciccotti, S Meloni
Physical Chemistry Chemical Physics 13 (13), 5952-5959, 2011
Mandater: Science Foundation Ireland
Nucleation of molecular crystals driven by relative information entropy
G Gobbo, MA Bellucci, GA Tribello, G Ciccotti, BL Trout
Journal of chemical theory and computation 14 (2), 959-972, 2018
Mandater: UK Engineering and Physical Sciences Research Council
A general mechanism for signal propagation in the nicotinic acetylcholine receptor family
ASF Oliveira, CJ Edsall, CJ Woods, P Bates, GV Nunez, S Wonnacott, ...
Journal of the American Chemical Society 141 (51), 19953-19958, 2019
Mandater: UK Biotechnology and Biological Sciences Research Council, UK Engineering …
Non-equilibrium by molecular dynamics: a dynamical approach
G Ciccotti, M Ferrario
Molecular Simulation 42 (16), 1385-1400, 2016
Mandater: Government of Italy
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