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

Authors:

Noack, Marcus M.;

; Fukuto, Masafumi;

; Li, Ruipeng; Sethian, James A.

Publication Date:: 2019-08-14

Research Org.:: Brookhaven National Lab. (BNL), Upton, NY (United States); Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: 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)

OSTI Identifier:: 1619572

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

Report Number(s):: BNL-211994-2019-JAAM; BNL-219838-2020-JAAM
Journal ID: ISSN 2045-2322; 11809; PII: 48114

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

Resource Type:: Published Article

Journal Name:: Scientific Reports

Additional Journal Information:: Journal Name: Scientific Reports Journal Volume: 9 Journal Issue: 1; Journal ID: ISSN 2045-2322

Publisher:: Nature Publishing Group

Country of Publication:: United Kingdom

Language:: English

Subject:: 36 MATERIALS SCIENCE

Citation Formats


                    Noack, Marcus M., Yager, Kevin G., Fukuto, Masafumi, Doerk, Gregory S., Li, Ruipeng, and Sethian, James A. A Kriging-Based Approach to Autonomous Experimentation with Applications to X-Ray Scattering.  United Kingdom: N. p., 2019. 
Web.  doi:10.1038/s41598-019-48114-3.

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                    Noack, Marcus M., Yager, Kevin G., Fukuto, Masafumi, Doerk, Gregory S., Li, Ruipeng, & Sethian, James A. A Kriging-Based Approach to Autonomous Experimentation with Applications to X-Ray Scattering.  United Kingdom.  https://doi.org/10.1038/s41598-019-48114-3

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                    Noack, Marcus M., Yager, Kevin G., Fukuto, Masafumi, Doerk, Gregory S., Li, Ruipeng, and Sethian, James A. Wed .  
"A Kriging-Based Approach to Autonomous Experimentation with Applications to X-Ray Scattering".  United Kingdom.  https://doi.org/10.1038/s41598-019-48114-3.

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@article{osti_1619572,

  title        = {A Kriging-Based Approach to Autonomous Experimentation with Applications to X-Ray Scattering},

  author       = {Noack, Marcus M. and Yager, Kevin G. and Fukuto, Masafumi and Doerk, Gregory S. and Li, Ruipeng and Sethian, James A.},

  abstractNote = {},

  doi          = {10.1038/s41598-019-48114-3},

  journal      = {Scientific Reports},

  number       = 1,

  volume       = 9,

  place        = {United Kingdom},

  year         = {2019},

  month        = {8}

}

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

Citation Formats

The origins of kriging journal, April 1990

Accelerated discovery of metallic glasses through iteration of machine learning and high-throughput experiments journal, April 2018

Gaussian Processes for Machine Learning journal, April 2004

Accelerating materials property predictions using machine learning journal, September 2013

Thickness-Dependent Ordering Kinetics in Cylindrical Block Copolymer/Homopolymer Ternary Blends journal, December 2018

Beyond native block copolymer morphologies journal, January 2017

Rapid Ordering in “Wet Brush” Block Copolymer/Homopolymer Ternary Blends journal, October 2016

Optimization of a Carbon Dioxide-Assisted Nanoparticle Deposition Process Using Sequential Experimental Design with Adaptive Design Space journal, March 2012

Accelerated search for materials with targeted properties by adaptive design journal, April 2016

X-Ray Photon Correlation Spectroscopy Study of Brownian Motion of Gold Colloids in Glycerol journal, July 1995

Dynamic X-ray diffraction sampling for protein crystal positioning journal, January 2017

Adaptive Strategies for Materials Design using Uncertainties journal, January 2016

Autonomy in materials research: a case study in carbon nanotube growth journal, October 2016

How To Optimize Materials and Devices via Design of Experiments and Machine Learning: Demonstration Using Organic Photovoltaics journal, July 2018

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A Supervised Learning Approach for Dynamic Sampling journal, February 2016

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The origins of kriging
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Accelerated discovery of metallic glasses through iteration of machine learning and high-throughput experiments
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journal, April 2004

Accelerating materials property predictions using machine learning
journal, September 2013

Thickness-Dependent Ordering Kinetics in Cylindrical Block Copolymer/Homopolymer Ternary Blends
journal, December 2018

Beyond native block copolymer morphologies
journal, January 2017

Rapid Ordering in “Wet Brush” Block Copolymer/Homopolymer Ternary Blends
journal, October 2016

Optimization of a Carbon Dioxide-Assisted Nanoparticle Deposition Process Using Sequential Experimental Design with Adaptive Design Space
journal, March 2012

Accelerated search for materials with targeted properties by adaptive design
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X-Ray Photon Correlation Spectroscopy Study of Brownian Motion of Gold Colloids in Glycerol
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