First-principles theoretical study of molecular HCl adsorption on a hexagonal ice (0001) surface

Journal of Physical Chemistry A

Volumn 105, Issue 29, 2001, Pages 7037-7046

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

^a MASSACHUSETTS INSTITUTE OF TECHNOLOGY   (United States)

^b USA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

HEXAGONAL ICE SURFACE;

ADSORPTION; BINDING ENERGY; ENTHALPY; HYDROCHLORIC ACID; IONIZATION OF GASES; MOLECULAR DYNAMICS; OZONIZATION; PHOTOLYSIS; PROBABILITY DENSITY FUNCTION;

CHEMISORPTION;

EID: 0035955005     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp010817u     Document Type: Article

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