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High-Throughput Screening Approach for Nanoporous Materials Genome Using Topological Data Analysis: Application to Zeolites
Yongjin Lee,
Senja D. Barthel,
Paweł Dłotko,
Seyed Mohamad Moosavi,
Kathryn Hess,
Berend Smit,
Pawel Dlotko
Journal of Chemical Theory and Computation, Volume: 14, Issue: 8, Pages: 4427 - 4437
Swansea University Author: Pawel Dlotko
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DOI (Published version): 10.1021/acs.jctc.8b00253
Abstract
High-Throughput Screening Approach for Nanoporous Materials Genome Using Topological Data Analysis: Application to Zeolites
Published in: | Journal of Chemical Theory and Computation |
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ISSN: | 1549-9618 1549-9626 |
Published: |
2018
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Online Access: |
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URI: | https://cronfa.swan.ac.uk/Record/cronfa44307 |
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College: |
Faculty of Science and Engineering |
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Issue: |
8 |
Start Page: |
4427 |
End Page: |
4437 |