Molecular dynamics simulation study of superhydrated perdeuterated natrolite using a new interaction potential model

Journal of Physical Chemistry B

Volumn 110, Issue 14, 2006, Pages 7513-7518

  Demontis, Pierfranco ^a   Gulín González, Jorge ^b,c   Suffritti, Giuseppe B ^a  

^a UNIVERSITY OF SASSARI   (Italy)

^b INSTITUTO SUPERIOR POLITÉCNICO JOSÉ ANTONIO ECHEVERRÍA   (Cuba)

^c UNIVERSIDAD DE LAS CIENCIAS INFORMÁTICAS   (Cuba)

Author keywords

[No Author keywords available]

Indexed keywords

HYDRATION; HYDROGEN BONDS; MATHEMATICAL MODELS; MOLECULAR STRUCTURE; NEUTRON DIFFRACTION; ZEOLITES;

INTERACTION POTENTIAL; MOLECULAR DYNAMICS SIMULATIONS; NATROLITE;

MOLECULAR DYNAMICS;

EID: 33646243807     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp060503c     Document Type: Article

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