Evidence map›Paper›PMID 37258522›Full record

ArticleNature communications2023

Machine learning-assisted crystal engineering of a zeolite.

Xinyu Li, He Han, Nikolaos Evangelou, Noah J Wichrowski, Peng Lu, Wenqian Xu, Son-Jong Hwang, Wenyang Zhao, Chunshan Song, Xinwen Guo and 3 more

Open access · goldAbstract read
In one paragraph

Article in Nature communications, 2023. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 13 papers.

0numbers the graph read from it
0cells of the map it votes in
13citing papers in PubMed
4.6field-weighted citation impact, top 4% of its field
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

13 citing papers in PubMed, 46 citations in OpenAlex.

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  6. Encapsulated Non-Exchangeable NaAngewandte Chemie (International ed. in English) · 2026
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4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

13 authors at 5 institutions in 2 countries.

Xinyu Li *Department of Chemical Engineering and Materials Science, University of Minnesota, 421 Washington Avenue SE, Minneapolis, MN, 55455, USA.
He Han *Department of Chemical Engineering and Materials Science, University of Minnesota, 421 Washington Avenue SE, Minneapolis, MN, 55455, USA.
Nikolaos Evangelou *Department of Chemical and Biomolecular Engineering, Johns Hopkins University, 3400 North Charles Street, Baltimore, MD, 21218, USA.
Noah J Wichrowski *Department of Applied Mathematics and Statistics, Johns Hopkins University, 3400 North Charles Street, Baltimore, MD, 21218, USA.
Peng LuDepartment of Chemical and Biomolecular Engineering, Johns Hopkins University, 3400 North Charles Street, Baltimore, MD, 21218, USA.
Wenqian XuX-ray Science Division, Advanced Photon Source, Argonne National Laboratory, Lemont, IL, 60439, USA.ORCID http://orcid.org/0000-0002-4815-6253
Son-Jong HwangDivision of Chemistry and Chemical Engineering, California Institute of Technology, Pasadena, CA, 91125, USA.
Wenyang ZhaoDepartment of Chemical Engineering and Materials Science, University of Minnesota, 421 Washington Avenue SE, Minneapolis, MN, 55455, USA.ORCID http://orcid.org/0000-0002-0828-3813
Chunshan SongState Key Laboratory of Fine Chemicals, PSU-DUT Joint Center for Energy Research, School of Chemical Engineering, Dalian University of Technology, Dalian, 116024, Liaoning Province, China.ORCID http://orcid.org/0000-0003-2344-9911
Xinwen GuoState Key Laboratory of Fine Chemicals, PSU-DUT Joint Center for Energy Research, School of Chemical Engineering, Dalian University of Technology, Dalian, 116024, Liaoning Province, China.ORCID http://orcid.org/0000-0002-6597-4979
Aditya BhanDepartment of Chemical Engineering and Materials Science, University of Minnesota, 421 Washington Avenue SE, Minneapolis, MN, 55455, USA. abhan@umn.edu.ORCID http://orcid.org/0000-0002-6069-7626
Ioannis G KevrekidisDepartment of Chemical and Biomolecular Engineering, Johns Hopkins University, 3400 North Charles Street, Baltimore, MD, 21218, USA. yannisk@jhu.edu.
Michael TsapatsisDepartment of Chemical Engineering and Materials Science, University of Minnesota, 421 Washington Avenue SE, Minneapolis, MN, 55455, USA. tsapatsis@jhu.edu.ORCID http://orcid.org/0000-0001-5610-3525
University of Minnesota · USJohns Hopkins University · USDalian University of Technology · CNArgonne National Laboratory · USCalifornia Institute of Technology · US

Funding

U.S. Department of Energy (DOE) DE-AC02-06CH11357U.S. Department of Energy (DOE) DE-FG02-12ER16362U.S. Department of Energy (DOE) DE-SC0001004U.S. Department of Energy (DOE) DE-SC00019028U.S. Department of Energy (DOE) DE-SC0023403
6 · The paper itself

Abstract

It is shown that Machine Learning (ML) algorithms can usefully capture the effect of crystallization composition and conditions (inputs) on key microstructural characteristics (outputs) of faujasite type zeolites (structure types FAU, EMT, and their intergrowths), which are widely used zeolite catalysts and adsorbents. The utility of ML (in particular, Geometric Harmonics) toward learning input-output relationships of interest is demonstrated, and a comparison with Neural Networks and Gaussian Process Regression, as alternative approaches, is provided. Through ML, synthesis conditions were identified to enhance the Si/Al ratio of high purity FAU zeolite to the hitherto highest level (i.e., Si/Al = 3.5) achieved via direct (not seeded), and organic structure-directing-agent-free synthesis from sodium aluminosilicate sols. The analysis of the ML algorithms' results offers the insight that reduced Na

Identifiers

PMID37258522
PMCPMC10232492
OpenAlexW4378806257

What OpenQuestion holds

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LicenceCC BY
Read underepoch 390

Registered trials

None linked

Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.