Influence of acid strength on the reactivity of alkane activation on solid acid catalysts: A theoretical calculation study

Microporous and Mesoporous Materials

Volumn 151, Issue , 2012, Pages 241-249

  Chu, Yueying ^a,b   Han, Bing ^a,b   Fang, Hanjun ^a   Zheng, Anmin ^a   Deng, Feng ^a  

^a Wuhan National Laboratory for Optoelectronics   (China)

^b UNIVERSITY OF CHINESE ACADEMY OF SCIENCES   (China)

Author keywords

Activation energy; Density functional theory; Deprotonation energy; Rate constant; Reaction acidic sensitivity

Indexed keywords

ACID STRENGTHS; ACTIVATION BARRIERS; ALKANE ACTIVATION; BOND FORMATION; C-H BOND DISSOCIATION; CH-BOND ACTIVATION; CRACKING REACTIONS; DENSITY FUNCTIONAL THEORY CALCULATIONS; DEPROTONATION ENERGY; HYDROGEN EXCHANGE; HYDROGEN EXCHANGE REACTIONS; IONIC CHARACTER; IONIC TRANSITION; ORGANIC FRAGMENTS; PROPANE DEHYDROGENATION; RATE COEFFICIENTS; REACTION ACIDIC SENSITIVITY; SOLID ACID; SOLID ACID CATALYSTS; THEORETICAL CALCULATIONS; TRANSITION STATE;

ACTIVATION ENERGY; C (PROGRAMMING LANGUAGE); CHEMICAL BONDS; DENSITY FUNCTIONAL THEORY; HYDROGEN; ION EXCHANGE; METHANE; PARAFFINS; PROPANE; RADIOACTIVITY LOGGING; RATE CONSTANTS;

IONIC STRENGTH;

EID: 84155165629     PISSN: 13871811     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.micromeso.2011.10.030     Document Type: Article

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