Calculation of MOF pore size distributions using PoreBlazer 4.0

Jonas Folke Sundberg

doi:10.17504/protocols.io.261ge671dl47/v1

Calculation of MOF pore size distributions using PoreBlazer 4.0

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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 language	English

DOIs	https://doi.org/10.17504/protocols.io.261ge671dl47/v1
Publication status	Published - 2022

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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",

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Calculation of MOF pore size distributions using PoreBlazer 4.0

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