Stefan-adrian F Nastase - Catalysis

Author Information

Stefan Adrian F. Nastase is affiliated with the Cardiff Catalysis Institute, School of Chemistry, Cardiff University, located at Park Place, Cardiff CF10 3AT, UK. His research focuses on catalysis, particularly in the study of zeolites and their reactivity.

Research Contributions

Stefan Adrian F. Nastase has made significant contributions to the field of catalysis, particularly in the study of zeolite-bound methoxy and carbene groups. His research employs quantum mechanics/molecular mechanics (QM/MM) methods to explore the reactivity and stability of these groups in various zeolite frameworks. Noteworthy among his works is the exploration of primary olefin formation from methanol and the mechanistic insights into framework methylation of H-ZSM-5. His studies have also delved into the direct hydrogenation of CO2 to hydrocarbons during zeolite-mediated bifunctional catalysis.

Aliases

Stefan Adrian F. Nastase is known by several aliases, including Stefan A F Nastase, Stefan A. F. Nastase, Stefan-adrian F Nastase, and Stefan Adrian F Nastase.

Publication and Citation Metrics

Metric	Value
Total Citations	86
H-Index	4
Total Papers Published	6

Publications:

QM/MM study of the reactivity of zeolite bound methoxy and carbene groups.

DOI: 10.1039/d1cp02535j

Year: 2021

Selectivity descriptors for the direct hydrogenation of CO2 to hydrocarbons during zeolite-mediated bifunctional catalysis

DOI: 10.1038/s41467-021-26090-5

Year: 2021

QM/MM Study of the Reactivity of Zeolite Bound Methoxy and Carbene Groups

DOI: 10.26434/chemrxiv.14737443

Year: 2021

QM/MM Study of the Reactivity of Zeolite Bound Methoxy and Carbene Groups

DOI: 10.26434/CHEMRXIV.14737443.V1

Year: 2021

A quantitative multiscale perspective on primary olefin formation from methanol.

DOI: 10.1039/d1cp02551a

Year: 2021

QM/MM study of the stability of dimethyl ether in zeolites H-ZSM-5 and H-Y.

DOI: 10.1039/d0cp05392a

Year: 2021

QM/MM Study of the Reactivity of Zeolite Bound Methoxy and Carbene Groups

DOI: 10.33774/chemrxiv-2021-xfjfh-v2

Year: 2021

QM/MM Study of the Reactivity of Zeolite Bound Methoxy and Carbene Groups

DOI: 10.33774/chemrxiv-2021-xfjfh-v3

Year: 2021

Mechanistic insight into the framework methylation of H-ZSM-5 for varying methanol loading and Si/Al ratio using first principles molecular dynamics simulations

DOI:

Year: 2020

Mechanistic Insight into the Framework Methylation of H-ZSM-5 for Varying Methanol Loadings and Si/Al Ratios Using First-Principles Molecular Dynamics Simulations

DOI: 10.1021/acscatal.0c01454

Year: 2020

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