Dataset for the paper "First-principles-based screening of subnanometric Ptn/M-MFI catalysts for high-efficient propane dehydrogenation"
Abstract
This repository contains all DFT-calculated structures from the research article titled "First-Principles-Based Screening of Subnanometric Ptₙ/M-MFI Catalysts for Highly Efficient Propane Dehydrogenation."
Fields of Study & Subjects
Catalysis and Oxidation Reactions
Zeolite Catalysis and Synthesis
Catalytic Processes in Materials Science
Publication details
- Journal / source
- Zenodo (CERN European Organization for Nuclear Research)
- Publication date
- 14 January 2026
- Document type
- Dataset