Theoretical investigation of the side-chain mechanism of the MTO process over H-SSZ-13 using DFT and ab initio calculations
Keyword(s):
The side-chain mechanism of the methanol-to-olefins process over the H-SSZ-13 acidic zeolite was investigated using periodic density functional theory with corrections from highly accurate ab intio calculations on large cluster models.
2000 ◽
Vol 2
(4)
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pp. 847-852
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1996 ◽
Vol 376
(1-3)
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pp. 325-342
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2005 ◽
Vol 237-240
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pp. 1129-1134
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1995 ◽
Vol 246
(1-2)
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pp. 9-12
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2001 ◽
Vol 7
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pp. 103-111
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