Investigating the interaction between methanol and the heulandite-type zeolite using first principle molecular dynamic

HIGHLIGHTS

• who: F.D. Wulandhani and F.I. Pambu from the Department of Chemistry, Universitas Gadjah Mada, Sekip Utara BLS , Yogyakarta, Indonesia have published the article: Investigating the Interaction between Methanol and the Heulandite-type Zeolite using First Principle Molecular Dynamic, in the Journal: (JOURNAL)
• what: This study provides an insight into the design of Heulandite type zeolite to give a catalytic activity toward methanol transformation. In term of the energy of the structure, this study provides two different positions of Al within the structure of Heulandite as shown in Figure 1(b) and_(c).
 



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