High-throughput screening approach for nanoporous materials...

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Journal of Chemical Theory and Computation 2018 / 07

High-throughput screening approach for nanoporous materials genome using topological data analysis: application to zeolites

Lee, Yongjin, Barthel, Senja D., Dlotko, Pawel, Moosavi, S. Mohamad, Hess, Kathryn, Smit, Berend
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Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ACS.JCTC.8B00253
Date:
July, 2018
File:
PDF, 2.03 MB
english, 2018
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