Combined atomistic simulation and quasielastic neutron scattering study of the low-temperature dynamics of hydrogen and deuterium confined in NaX zeolite

Journal of Physical Chemistry B

Volumn 112, Issue 37, 2008, Pages 11708-11715

  Pantatosaki, Evangelia ^a   Papadopoulos, George K ^b   Jobic, Hervé ^a   Theodorou, Doros N ^b  

^a INST DE RECHERCHES SUR LA CATALYSE   (France)

^b NATIONAL TECHNICAL UNIVERSITY OF ATHENS   (Greece)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; COMPUTER SIMULATION; CONCENTRATION (PROCESS); DEUTERIUM; HYDROGEN; MOLECULAR DYNAMICS; NEUTRON DIFFRACTION; NEUTRON SCATTERING; NEUTRONS; NONMETALS; QUANTUM CHEMISTRY; SILICATE MINERALS; SODIUM; SORPTION;

ATOMISTIC SIMULATION; EXPERIMENTAL MEASUREMENTS; FAUJASITE TYPE ZEOLITES; LOW TEMPERATURES; MOLECULAR DYNAMICS COMPUTER SIMULATIONS; NANO STRUCTURING; NAX ZEOLITE; PHASE CONCENTRATION; QUASI-ELASTIC NEUTRON SCATTERING; SORBATE; SORPTION THERMODYNAMICS; X-RAY DIFFRACTION;

DYNAMICS;

EID: 53049105522     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp8018342     Document Type: Article

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