AN INTERMOLECULAR POTENTIAL FUNCTION FOR THE N₂-H₂O SYSTEM FROM AB INITIO MO CALCULATIONSDEMONTIS P; GAMBA A; MANUNZA B et al.1982; MOLECULAR PHYSICS; ISSN 0026-8976; GBR; DA. 1982; VOL. 47; NO 2; PP. 347-354; BIBL. 20 REF.Article

Molecular dynamics study of zeolites: the role of disorderSUFFRITTI, G. B; DEMONTIS, P.Phase transitions (Print). 1994, Vol 52, Num 2-3, pp 191-211, issn 0141-1594Article

A THEORETICAL INVESTIGATION ON THE ROLE OF SOLVENT IN SOLVOLYTIC REACTIONS. V: FLUOROMETHANE IN METHANEDEMONTIS P; GAMBA A; SUFFRITTI GB et al.1983; C.S. PERKIN TRANSACTIONS 2; ISSN 0300-9580; GBR; DA. 1983; NO 7; PP. 997-1002; BIBL. 12 REF.Article

THEORETICAL STUDY OF THE SOLVATION OF NITROGEN: TWO DIFFERENT APPROACHESDEMONTIS P; ERCOLI R; FOIS ES et al.1981; THEOR. CHIM. ACTA; ISSN 0040-5744; DEU; DA. 1981; VOL. 58; NO 2; PP. 97-109; BIBL. 31 REF.Article

A THEORETICAL INVESTIGATION OF THE ENERGY AND STRUCTURE OF ION-MOLECULE PAIRS IN POLAR SOLVENTS. II: METHANEDIAZONIUM CATION IN WATERDEMONTIS P; ERCOLI R; GAMBA A et al.1981; C.S. PERKIN TRANS. 2; ISSN 0300-9580; GBR; DA. 1981; NO 3; PP. 488-493; BIBL. 15 REF.Article

Molecular dynamics investigation of the diffusion of methane in a cubic symmetry zeolite of type ZK4DEMONTIS, P; SUFFRITTI, G. B.Chemical physics letters. 1994, Vol 223, Num 4, pp 355-362, issn 0009-2614Article

Localization and mobility of benzene in sodium-Y zeolite by molecular dynamics calculationsDEMONTIS, P; SUBRAMANIAN YASHONATH; KLEIN, M. L et al.Journal of physical chemistry (1952). 1989, Vol 93, Num 13, pp 5016-5019, issn 0022-3654Article

Molecular dynamics studies on zeolites. III: Dehydrated zeolite ADEMONTIS, P; SUFFRITTI, G. B; QUARTIERI, S et al.Journal of physical chemistry (1952). 1988, Vol 92, Num 4, pp 867-871, issn 0022-3654Article

The behaviour of water confined in zeolites: molecular dynamics simulations versus experimentDEMONTIS, P; GULIN-GONZALEZ, J; MASIA, M et al.Journal of physics. Condensed matter (Print). 2010, Vol 22, Num 28, issn 0953-8984, 284106.1-284106.13Conference Paper

Temperature and concentration dependence of adsorption properties of methane in NaY : a molecular dynamics studySUBRAMANIAN YASHONATH; DEMONTIS, P; KLEIN, M. L et al.Journal of physical chemistry (1952). 1991, Vol 95, Num 15, pp 5881-5889, issn 0022-3654, 9 p.Article

A molecular dynamics study and molecular level explanation of pressure dependence of ionic conductivity of potassium chloride in waterVARANASI, Srinivasa R; KUMAR, Parveen; MASIA, Marco et al.PCCP. Physical chemistry chemical physics (Print). 2011, Vol 13, Num 23, pp 10877-10884, issn 1463-9076, 8 p.Article

Molecular dynamics studies on zeolites. IV, Diffusion of methane in silicaliteDEMONTIS, P; FOIS, E. S; SUFFRITTI, G. B et al.Journal of physical chemistry (1952). 1990, Vol 94, Num 10, pp 4329-4334, issn 0022-3654, 6 p.Article

α-Amphetamine and active behavior-induced changes of regional brain ascorbic acid levels in the ratDESOLE, M. S; MIELE, M; DEMONTIS, P et al.Pharmacological research communications. 1988, Vol 20, Num 6, pp 499-509, issn 0031-6989Article

A molecular dynamics study of diffusion of methane in silicalite molecular sieve at high dilutionDEMONTIS, P; SUFFRITTI, G. B; MURA, P et al.Chemical physics letters. 1992, Vol 191, Num 6, pp 553-560, issn 0009-2614Article

A molecular dynamics study of methane in zeolite NaYYASHONATH, S; DEMONTIS, P; KLEIN, M. L et al.Chemical physics letters. 1988, Vol 153, Num 6, pp 551-556, issn 0009-2614Article

New high-pressure phases of iceDEMONTIS, P; LESAR, R; KLEIN, M. L et al.Physical review letters. 1988, Vol 60, Num 22, pp 2284-2287, issn 0031-9007Article

A THEORETICAL INVESTIGATION OF THE ROLE OF THE SOLVENT ON THE STRUCTURE OF THE INTERMEDIATES IN SOLVOLYTIC REACTIONS. IV: METHANEDIAZONIUM ION AND METHYL FLUORIDE IN HYDROFLUORIC ACIDDEMONTIS P; FOIS E; GAMBA A et al.1982; C.S. PERKIN TRANS. 2; ISSN 0300-9580; GBR; DA. 1982; NO 7; PP. 783-788; BIBL. 9 REF.Article

Molecular dynamics simulation of anomalous diffusion of one-dimensional water molecule chains in Li-ABW zeoliteDEMONTIS, P; STARA, G; SUFFRITTI, G. B et al.Microporous and mesoporous materials. 2005, Vol 86, Num 1-3, pp 166-175, issn 1387-1811, 10 p.Article

Monte Carlo studies of aqueous solution of nitrogen using different potential energy surfacesFOIS, E. S; GAMBA, A; MOROSI, G et al.Molecular physics (Print). 1986, Vol 58, Num 1, pp 65-83, issn 0026-8976Article

Computer simulations of dynamic crossover phenomena in nanoconfined water : DYNAMIC CROSSOVER PHENOMENA IN WATER AND OTHER GLASS-FORMING LIQUIDSSUFFRITTI, G. B; DEMONTIS, P; GULIN-GONZALEZ, J et al.Journal of physics. Condensed matter (Print). 2012, Vol 24, Num 6, issn 0953-8984, 064110.1-064110.11Article

A study of the pressure-induced reversible amorphization of Xe containing-LTA zeolites by energy minimization techniqueGULIN GONZALEZ, J; DORTA-URRA, A; DEMONTIS, P et al.Microporous and mesoporous materials. 2009, Vol 123, Num 1-3, pp 30-38, issn 1387-1811, 9 p.Article

An effective harmonic potential for aluminophosphate molecular sieves : application to AlPO₄-5DEMONTIS, P; GULIN GONZALEZ, J; SUFFRITTI, G. B et al.Microporous and mesoporous materials. 2001, Vol 42, Num 1, pp 103-111, issn 1387-1811Article

Application of the two-step model to the diffusion of linear diatomic and triatomic molecules in silicaliteDEMONTIS, P; KÄRGER, J; SUFFRITTI, G. B et al.PCCP. Physical chemistry chemical physics (Print). 2000, Vol 2, Num 7, pp 1455-1463, issn 1463-9076Article

Molecular dynamics studies on zeolites. VI: Temperature dependence of diffusion of methane in silicaliteDEMONTIS, P; SUFFRITTI, G. B; FOIS, E. S et al.Journal of physical chemistry (1952). 1992, Vol 96, Num 3, pp 1482-1490, issn 0022-3654Article

Molecular dynamics studies on zeolites. V, Discussion of the structural changes of silicaliteDEMONTIS, P; SUFFRITTI, G. B; GAMBA, A et al.Journal of the Chemical Society. Faraday transactions. 1991, Vol 87, Num 10, pp 1657-1663, 7 p.Article