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- Conference Paper
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Theoretical verification of the alkene hydrocarbon pool cycle for MTO conversion in ZSM-5
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- Conference Paper
- C3
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Theoretical identification of the interactions between the zeolite framework and the hydrocarbon pool co-catalyst in methanol-to-olefin conversion
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Theoretical insights on methylbenzene side-chain growth in ZSM-5 zeolites for methanol-to-olefin conversion
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The effect of confined space on the growth of naphthalenic species in a chabazite-type catalyst: a molecular modeling study
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- Conference Paper
- C3
- open access
Identification of the driving forces in methanol-to-olefin conversion by modeling the zeolite cage and contents
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Using elementary reactions to model growth processes of polyaromatic hydrocarbons under pyrolysis conditions of light feedstocks
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- Conference Paper
- C3
- open access
Use of ring-closing metathesis to form trans-fused macrocyclic bis(hydantoins): synthesis and theory
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- Conference Paper
- C3
- open access
Theoretical study on the genesis of new hydrocarbon pool compounds during MTO conversion in zeolites
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- Conference Paper
- C3
- open access
A combined experimental and theoretical investigation of the stereoselectivity in the synthesis of azahetrocyclic phosphonates
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- Conference Paper
- C3
- open access
Normal modes in partially optimized molecular systems: the Mobile Block Hessian (MBH) approach
(2008)