Calculation of MOF pore size distributions using PoreBlazer 4.0

Research output: Book/ReportCompendium/lecture notes

Abstract

This is a brief step-by-step protocol for how to calculate and plot the pore-size distribution (PSD) of a metal-organic framework. The protocol uses the nice PoreBlazer software made by Sarkisov et. al., for in-depth information read their paper:
'Materials Informatics with PoreBlazer v4.0 and the CSD MOF Database'
Chem. Mater.2020, 32, 23, 9849–9867
https://doi.org/10.1021/acs.chemmater.0c03575
Original languageEnglish
DOIs
Publication statusPublished - 2022

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