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2021
DOI: 10.1016/j.patter.2021.100305
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Hydrogen storage in MOFs: Machine learning for finding a needle in a haystack

Abstract: In recent years, machine learning (ML) has grown exponentially within the field of structure property predictions in materials science. In this issue of Patterns, Ahmed and Siegel scrutinize several redeveloped ML techniques for systematic investigations of over 900,000 metal-organic framework (MOF) structures, taken from 19 databases, to discover new, potentially record-breaking, hydrogen-storage materials.

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Cited by 5 publications
(2 citation statements)
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References 12 publications
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“…In 1956, John McCarthy coined the term “artificial intelligence” (AI), marking the inception of a computer science subfield centered on machine learning (ML) and an aspiration to emulate human intelligence . AI-driven algorithms have since permeated diverse disciplines, , with notable advancements in sectors such as image understanding, pattern recognition, autonomous driving, automatic programming, big data, , robotics, and human-machine collaboration . Despite their transformative potential, the inner mechanics of AI remain obscured.…”
Section: Introductionmentioning
confidence: 99%
“…In 1956, John McCarthy coined the term “artificial intelligence” (AI), marking the inception of a computer science subfield centered on machine learning (ML) and an aspiration to emulate human intelligence . AI-driven algorithms have since permeated diverse disciplines, , with notable advancements in sectors such as image understanding, pattern recognition, autonomous driving, automatic programming, big data, , robotics, and human-machine collaboration . Despite their transformative potential, the inner mechanics of AI remain obscured.…”
Section: Introductionmentioning
confidence: 99%
“…While MOFs have shown promising potential for hydrogen storage, several challenges need to be addressed for their practical use, including the need to optimize the pore size and surface area for hydrogen storage, the development of efficient regeneration methods to release the stored hydrogen, and the need to address the stability of MOFs under high-pressure hydrogen adsorption conditions. Nevertheless, MOFs represent a promising avenue for hydrogen storage, and ongoing research in this field is expected to further advance their development for practical applications[252,253].…”
mentioning
confidence: 99%