A Kriging-Based Approach to Autonomous Experimentation with Applications to X-Ray Scattering

Noack, Marcus M.; Yager, Kevin G.; Fukuto, Masafumi; Doerk, Gregory S.; Li, Ruipeng; Sethian, James A.

doi:10.1038/s41598-019-48114-3

Title: A Kriging-Based Approach to Autonomous Experimentation with Applications to X-Ray Scattering

Journal Article · Wed Aug 14 00:00:00 EDT 2019 · Scientific Reports

DOI:https://doi.org/10.1038/s41598-019-48114-3· OSTI ID:1619572

Noack, Marcus M.;

; Fukuto, Masafumi;

; Li, Ruipeng; Sethian, James A.

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Research Organization:: Brookhaven National Laboratory (BNL), Upton, NY (United States); Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES); USDOE Office of Science (SC), Advanced Scientific Computing Research (ASCR). Scientific Discovery through Advanced Computing (SciDAC)

Grant/Contract Number:: SC0012704; AC02-05CH11231

OSTI ID:: 1619572

Alternate ID(s):: OSTI ID: 1558244; OSTI ID: 1580907; OSTI ID: 1661648

Report Number(s):: BNL-211994-2019-JAAM; BNL-219838-2020-JAAM; 11809; PII: 48114

Journal Information:: Scientific Reports, Journal Name: Scientific Reports Vol. 9 Journal Issue: 1; ISSN 2045-2322

Publisher:: Nature Publishing GroupCopyright Statement

Country of Publication:: United Kingdom

Language:: English

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Cited by: 45 works

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References (20)

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Thickness-Dependent Ordering Kinetics in Cylindrical Block Copolymer/Homopolymer Ternary Blends Doerk, Gregory S.; Li, Ruipeng; Fukuto, Masafumi Macromolecules, Vol. 51, Issue 24 https://doi.org/10.1021/acs.macromol.8b01773	journal	December 2018
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Rapid Ordering in “Wet Brush” Block Copolymer/Homopolymer Ternary Blends Doerk, Gregory S.; Yager, Kevin G. ACS Nano, Vol. 11, Issue 12 https://doi.org/10.1021/acsnano.7b06154	journal	October 2016
Optimization of a Carbon Dioxide-Assisted Nanoparticle Deposition Process Using Sequential Experimental Design with Adaptive Design Space Casciato, Michael J.; Kim, Sungil; Lu, J. C. Industrial & Engineering Chemistry Research, Vol. 51, Issue 11 https://doi.org/10.1021/ie2028574	journal	March 2012
Accelerated search for materials with targeted properties by adaptive design Xue, Dezhen; Balachandran, Prasanna V.; Hogden, John Nature Communications, Vol. 7, Issue 1 https://doi.org/10.1038/ncomms11241	journal	April 2016
X-Ray Photon Correlation Spectroscopy Study of Brownian Motion of Gold Colloids in Glycerol Dierker, S. B.; Pindak, R.; Fleming, R. M. Physical Review Letters, Vol. 75, Issue 3 https://doi.org/10.1103/PhysRevLett.75.449	journal	July 1995
Dynamic X-ray diffraction sampling for protein crystal positioning Scarborough, Nicole M.; Godaliyadda, G. M. Dilshan P.; Ye, Dong Hye Journal of Synchrotron Radiation, Vol. 24, Issue 1 https://doi.org/10.1107/S160057751601612X	journal	January 2017
Adaptive Strategies for Materials Design using Uncertainties Balachandran, Prasanna V.; Xue, Dezhen; Theiler, James Scientific Reports, Vol. 6, Issue 1 https://doi.org/10.1038/srep19660	journal	January 2016
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How To Optimize Materials and Devices via Design of Experiments and Machine Learning: Demonstration Using Organic Photovoltaics Cao, Bing; Adutwum, Lawrence A.; Oliynyk, Anton O. ACS Nano, Vol. 12, Issue 8 https://doi.org/10.1021/acsnano.8b04726	journal	July 2018
On-the-fly machine-learning for high-throughput experiments: search for rare-earth-free permanent magnets Kusne, Aaron Gilad; Gao, Tieren; Mehta, Apurva Scientific Reports, Vol. 4, Issue 1 https://doi.org/10.1038/srep06367	journal	September 2014
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