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  Machine learning on neutron and x-ray scattering and spectroscopies

Chen, Z., Andrejevic, N., Drucker, N., Nguyen, T., Xian, R. P., Smidt, T., et al. (2021). Machine learning on neutron and x-ray scattering and spectroscopies. Chemical Physics Reviews, 2(3): 031301. doi:10.1063/5.0049111.

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 Urheber:
Chen, Zhantao1, 2, Autor
Andrejevic, Nina1, 3, Autor
Drucker, Nathan1, 4, Autor
Nguyen, Thanh1, 5, Autor
Xian, R. Patrick6, Autor           
Smidt, Tess7, Autor
Wang, Yao8, Autor
Ernstorfer, Ralph6, Autor           
Tennant, Alan9, Autor
Chan, Maria10, Autor
Li, Mingda1, 5, Autor
Affiliations:
1Quantum Matter Group, MIT, Cambridge, MA 02139, USA, ou_persistent22              
2Department of Mechanical Engineering, MIT, Cambridge, MA 02139, USA, ou_persistent22              
3Department of Materials Science and Engineering, MIT, Cambridge, MA 02139, USA, ou_persistent22              
4Department of Applied Physics, School of Engineering and Applied Sciences, Harvard University, Cambridge, MA 02138, USA, ou_persistent22              
5Department of Nuclear Science and Engineering, MIT, Cambridge, MA 02139, USA, ou_persistent22              
6Physical Chemistry, Fritz Haber Institute, Max Planck Society, ou_634546              
7Computational Research Division and Center for Advanced Mathematics for Energy Research Application, Lawrence Berkeley National Laboratory, Berkeley, CA 94720, USA, ou_persistent22              
8Department of Physics and Astronomy, Clemson University, Clemson, SC 29634, USA, ou_persistent22              
9Neutron Scattering Division, Oak Ridge National Laboratory, Oak Ridge, TN 37831, USA, ou_persistent22              
10Center for Nanoscale Materials, Argonne National Laboratory, Lemont, IL 60439, USA, ou_persistent22              

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Schlagwörter: Condensed Matter, Materials Science, cond-mat.mtrl-sci
 Zusammenfassung: Neutron and X-ray scattering represent two state-of-the-art materials characterization techniques that measure materials' structural and dynamical properties with high precision. These techniques play critical roles in understanding a wide variety of materials systems, from catalysis to polymers, nanomaterials to macromolecules, and energy materials to quantum materials. In recent years, neutron and X-ray scattering have received a significant boost due to the development and increased application of machine learning to materials problems. This article reviews the recent progress in applying machine learning techniques to augment various neutron and X-ray scattering techniques. We highlight the integration of machine learning methods into the typical workflow of scattering experiments. We focus on scattering problems that faced challenge with traditional methods but addressable using machine learning, such as leveraging the knowledge of simple materials to model more complicated systems, learning with limited data or incomplete labels, identifying meaningful spectra and materials' representations for learning tasks, mitigating spectral noise, and many others. We present an outlook on a few emerging roles machine learning may play in broad types of scattering and spectroscopic problems in the foreseeable future.

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Sprache(n): eng - English
 Datum: 2021-02-052021-03-012021-06-082021-09
 Publikationsstatus: Online veröffentlicht
 Seiten: 26
 Ort, Verlag, Ausgabe: -
 Inhaltsverzeichnis: -
 Art der Begutachtung: Expertenbegutachtung
 Art des Abschluß: -

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Projektname : FLATLAND - Electron-lattice-spin correlations and many-body phenomena in 2D semiconductors and related heterostructures
Grant ID : 682843
Förderprogramm : Horizon 2020 (H2020)
Förderorganisation : European Commission (EC)

Quelle 1

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Titel: Chemical Physics Reviews
  Kurztitel : Chem. Phys. Rev.
Genre der Quelle: Zeitschrift
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Ort, Verlag, Ausgabe: AIP Publ.
Seiten: 26 Band / Heft: 2 (3) Artikelnummer: 031301 Start- / Endseite: - Identifikator: ISSN: 2688-4070
CoNE: https://pure.mpg.de/cone/journals/resource/2688-4070