DOI: 10.1021/jacs.7b08460. Disentangling Structural Confusion through Machine Learning: Structure Prediction and Polymorphism of Equiatomic Ternary Phases <i>ABC</i>

Disentangling Structural Confusion through Machine Learning: Structure Prediction and Polymorphism of Equiatomic Ternary Phases ABC

10.1021/jacs.7b08460

Crossref journal-article

American Chemical Society (ACS)

Journal of the American Chemical Society (316)

Bibliography

Oliynyk, A. O., Adutwum, L. A., Rudyk, B. W., Pisavadia, H., Lotfi, S., Hlukhyy, V., Harynuk, J. J., Mar, A., & Brgoch, J. (2017). Disentangling Structural Confusion through Machine Learning: Structure Prediction and Polymorphism of Equiatomic Ternary Phases ABC. Journal of the American Chemical Society, 139(49), 17870â17881.

Authors 9

Anton O. Oliynyk (first)
Lawrence A. Adutwum (additional)
Brent W. Rudyk (additional)
Harshil Pisavadia (additional)
Sogol Lotfi (additional)
Viktor Hlukhyy (additional)
James J. Harynuk (additional)
Arthur Mar (additional)
Jakoah Brgoch (additional)

References 81 Referenced 81

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{'volume-title': 'The Nature of the Chemical Bond and the Structure of Molecules and Crystals', 'year': '1960', 'author': 'Pauling L.', 'key': 'ref2/cit2'} / The Nature of the Chemical Bond and the Structure of Molecules and Crystals by Pauling L. (1960)
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Dates

Type	When
Created	7 years, 9 months ago (Nov. 13, 2017, 1:48 a.m.)
Deposited	2 years, 4 months ago (April 15, 2023, 2:21 p.m.)
Indexed	4 weeks ago (July 28, 2025, 5:09 p.m.)
Issued	7 years, 8 months ago (Nov. 28, 2017)
Published	7 years, 8 months ago (Nov. 28, 2017)
Published Online	7 years, 8 months ago (Nov. 28, 2017)
Published Print	7 years, 8 months ago (Dec. 13, 2017)

Funders 3

University of Houston 10.13039/100007144
Region: Americas
gov (Universities (academic only))
Labels2
1. The University of Houston
2. UH
Division of Civil, Mechanical and Manufacturing Innovation 10.13039/100000147
Region: Americas
gov (National government)
Labels7
1. Civil, Mechanical and Manufacturing Innovation
2. Division of Civil, Mechanical & Manufacturing Innovation
3. NSF Civil, Mechanical and Manufacturing Innovation
4. NSF Division of Civil, Mechanical & Manufacturing Innovation
5. National Science Foundation Division of Civil, Mechanical, and Manufacturing Innovation
6. CMMI
7. ENG/CMMI
Awards1
1. 15-62142
Natural Sciences and Engineering Research Council of Canada 10.13039/501100000038
Region: Americas
gov (National government)
Labels3
1. Conseil de Recherches en Sciences Naturelles et en Génie du Canada
2. NSERC
3. CRSNG

BibTeX

@article{Oliynyk_2017, title={Disentangling Structural Confusion through Machine Learning: Structure Prediction and Polymorphism of Equiatomic Ternary Phases ABC}, volume={139}, ISSN={1520-5126}, url={http://dx.doi.org/10.1021/jacs.7b08460}, DOI={10.1021/jacs.7b08460}, number={49}, journal={Journal of the American Chemical Society}, publisher={American Chemical Society (ACS)}, author={Oliynyk, Anton O. and Adutwum, Lawrence A. and Rudyk, Brent W. and Pisavadia, Harshil and Lotfi, Sogol and Hlukhyy, Viktor and Harynuk, James J. and Mar, Arthur and Brgoch, Jakoah}, year={2017}, month=nov, pages={17870–17881} }

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