A theoretical study of the interaction of HCl with crystalline NAT

Journal of Physical Chemistry A

Volumn 106, Issue 30, 2002, Pages 6972-6981

  Mantz, Yves A ^a,b   Geiger, Franz M ^a,c   Molina, Luisa T ^a   Molina, Mario J ^a   Trout, Bernhardt L ^d  

^a MASSACHUSETTS INSTITUTE OF TECHNOLOGY   (United States)

^b IBM T J WATSON RESEARCH CENTER   (United States)

^c NORTHWESTERN UNIVERSITY   (United States)

^d Massachusetts Institute of Technology Cambridge   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CRYSTALLINE MATERIALS; HYDROCHLORIC ACID; HYDROGEN BONDS; MOLECULAR DYNAMICS; PROBABILITY DENSITY FUNCTION; REACTION KINETICS; THERMODYNAMICS;

SURFACE BINDING;

SURFACE CHEMISTRY;

EID: 0036703838     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0144754     Document Type: Article

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