Methanol in microporous materials from first principles

Catalysis Today

Volumn 50, Issue 3-4, 1999, Pages 525-532

  Gale, J D ^a   Shah, R ^b   Payne, M C ^b   Stich, I ^c   Terakura, K ^c  

^a IMPERIAL COLLEGE LONDON   (United Kingdom)

^b UNIVERSITY OF CAMBRIDGE   (United Kingdom)

^c JT RES CENTER FOR ATOM TECHNOLOGY   (Japan)

Author keywords

Br nsted acid site; First principles molecular dynamics; Methanol to gasoline; Mulliken charges

Indexed keywords

EID: 0000926286     PISSN: 09205861     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0920-5861(98)00487-8     Document Type: Article

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