DEMONTIS, Pierfranco

DEMONTIS, Pierfranco  

SCIENZE CHIMICHE, FISICHE, MATEMATICHE E NATURALI  

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Risultati 1 - 20 di 211 (tempo di esecuzione: 0.017 secondi).
Titolo Data di pubblicazione Autore(i) File
"Two-step" model of molecular diffusion in silicalite 1-gen-1999 Demontis, Pierfranco; Kärger, Jörg; Suffritti, Giuseppe Baldovino; Tilocca, Antonio
'Two step' model of molecular diffusion in silicalite 1-gen-1999 Kaerger, J.; Demontis, P.; Suffritti, Giuseppe Baldovino; Tilocca, A.
A "coarse-grained" model based on a cellular automaton for the study of diffusion in microporous materials 1-gen-2005 Demontis, Pierfranco; Suffritti, Giuseppe Baldovino; Pazzona, Federico Giovanni
A 'coarse-grained' model based on a cellular automaton for the study of diffusion in microporous materials 1-gen-2005 Demontis, Pierfranco; Pazzona, Federico Giovanni; Suffritti, Giuseppe Baldovino
A Classical molecular dynamics study of recombination reactions in a microporous solid 1-gen-1998 Demontis, Pierfranco; Delogu, Francesco; Tilocca, Antonio; Suffritti, Giuseppe Baldovino
A classical Molecular Dynamics study of recombination reactions in a microporous solid 1-gen-1998 Delogu, F.; Demontis, P.; Suffritti, Giuseppe Baldovino; Tilocca, A:
A coarse-grained method based on the analysis of short MD trajectories for the simulation of non-markovian dinamics of sorbates in microporous materials 1-gen-2014 Pintus, Alberto Maria; Gabrieli, A.; Pazzona, F. G.; Demontis, P.; Suffritti, Giuseppe Baldovino
A Coarse-grained model for diffusion in zeolites based on clustering of short MD trajectories 1-gen-2013 Pazzona, Federico Giovanni; Demontis, Pierfranco; Pintus, Alberto M.; Gabrieli, Andrea; Suffritti, Giuseppe Baldovino
A Combined Energy-Force Fitting Procedure to Develop DFT-Based Force Fields 1-gen-2016 Gabrieli, Andrea; Sant, Marco; Demontis, Pierfranco; Suffritti, Giuseppe Baldovino
A comment on the flexibility of framework in molecular dynamics simulations of zeolites 1-gen-2009 Demontis, Pierfranco; Suffritti, Giuseppe Baldovino
A comparative molecular dynamics study of diffusion of n-decane and 3-methyl pentane in Y zeolite 1-gen-2009 PAZZONA F., G; BORAH B., J; Demontis, Pierfranco; Suffritti, Giuseppe Baldovino; Yashonath, S.
A CTRW interpretation of simulated single-file diffusion in zeolites 1-gen-2005 Demontis, Pierfranco; Suffritti, Giuseppe Baldovino
A CTRW interpretation of simulated single-file diffusion in zeolites 1-gen-2005 Demontis, Pierfranco; Suffritti, Giuseppe Baldovino
A grand-canonical Monte Carlo study of the adsorption properties of argon confined in ZIF-8: Local thermodynamic modeling 1-gen-2013 Pazzona, Federico Giovanni; Demontis, Pierfranco; Suffritti, Giuseppe Baldovino
A lattice dynamics study of ZK-4 microporous material under different temperature and pressure conditions 1-gen-2016 Gulín González, Jorge; Torres Pupo, Carlos; Navas Conyedo, Edisel; Ruiz Puentes, Andrés; Demontis, Pierfranco; Suffritti, Giuseppe Baldovino
A Lattice-Gas Cellular Automaton to Model Diffusion in Restricted Geometries 1-gen-2006 Demontis, Pierfranco; Pazzona, F; Suffritti, Giuseppe Baldovino
A method for correcting empirical potentials. Application to water molecule 1-gen-1985 Demontis, P.; Fois, E. S.; Gamba, A.; Suffritti, Giuseppe Baldovino
A molecular dynamics and molecular level explanation of pressure dependence of ionic conductivity of potassium chloride in water 1-gen-2011 Varanasi, S. R.; Kumar, P.; Masia, Marco; Demontis, Pierfranco; Suffritti, Giuseppe Baldovino; Yashonath, S.
A molecular dynamics study of diffusion of methane in partially dealuminated zeolite Na A 1-gen-1997 Demontis, P.; Suffritti, Giuseppe Baldovino
A Molecular Dynamics study on diffusion of methane in silicalite at four different temperatures 1-gen-1991 Demontis, P.; Suffritti, Giuseppe Baldovino