Paired interacting orbitals (PIO) study of Mo/SiO 2 and Mo/HZSM-5 catalysts for olefin metathesis

Computational and Theoretical Chemistry

Volumn 991, Issue , 2012, Pages 174-181

  Handzlik, Jarosław ^a   Czernecki, Marcin ^a   Shiga, Akinobu ^b   Śliwa, Paweł ^a  

^a CRACOW UNIVERSITY OF TECHNOLOGY   (Poland)

^b LUMMOX Research Laboratory   (Japan)

Author keywords

Metathesis catalyst; Molybdenum; Overlap population; Paired interacting orbitals; Silica; ZSM 5

Indexed keywords

EID: 84861697466     PISSN: 2210271X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.comptc.2012.04.012     Document Type: Article

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