Dataset for the paper "First-principles-based screening of subnanometric Ptn/M-MFI catalysts for high-efficient propane dehydrogenation"

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Authors: Huahua Fan
Cited by: 0

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