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  Roadmap on data-centric materials science

Bauer, S., Benner, P., Bereau, T., Blum, V., Boley, M., Carbogno, C., et al. (2024). Roadmap on data-centric materials science. Modelling and Simulation in Materials Science and Engineering, 32(6): 063301. doi:10.1088/1361-651X/ad4d0d.

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Bauer, Stefan, Author
Benner, Peter, Author
Bereau, Tristan, Author
Blum, Volker, Author
Boley, Mario, Author
Carbogno, Christian, Author
Catlow, C Richard A, Author
Dehm, Gerhard, Author
Eibl, Sebastian1, Author           
Ernstorfer, Ralph, Author
Fekete, Ádám, Author
Foppa, Lucas, Author
Fratzl, Peter, Author
Freysoldt, Christoph, Author
Gault, Baptiste, Author
Ghiringhelli, Luca M, Author
Giri, Sajal K, Author
Gladyshev, Anton, Author
Goyal, Pawan, Author
Hattrick-Simpers, Jason, Author
Kabalan, Lara, AuthorKarpov, Petr1, Author           Khorrami, Mohammad S, AuthorKoch, Christoph T., AuthorKokott, Sebastian, AuthorKosch, Thomas, AuthorKowalec, Igor, AuthorKremer, Kurt, AuthorLeitherer, Andreas, AuthorLi, Yue, AuthorLiebscher, Christian H, AuthorLogsdail, Andrew J, AuthorLu, Zhongwei, AuthorLuong, Felix, AuthorMarek, Andreas1, Author           Merz, Florian, AuthorMianroodi, Jaber R, AuthorNeugebauer, Jörg, AuthorPei, Zongrui, AuthorPurcell, Thomas A R, AuthorRaabe, Dierk, AuthorRampp, Markus1, Author           Rossi, Mariana, AuthorRost, Jan-Michael, AuthorSaal, James, AuthorSaalmann, Ulf, AuthorSasidhar, Kasturi Narasimha, AuthorSaxena, Alaukik, AuthorSbailò, Luigi, AuthorScheidgen, Markus, AuthorSchloz, Marcel, AuthorSchmidt, Daniel F, AuthorTeshuva, Simon, AuthorTrunschke, Annette, AuthorWei, Ye, AuthorWeikum, Gerhard, AuthorXian, R Patrick, AuthorYao, Yi, AuthorYin, Junqi, AuthorZhao, Meng, AuthorScheffler, Matthias, Author more..
Affiliations:
1Max Planck Computing and Data Facility, Max Planck Society, ou_2364734              

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 Abstract: Science is and always has been based on data, but the terms 'data-centric' and the '4th paradigm' of materials research indicate a radical change in how information is retrieved, handled and research is performed. It signifies a transformative shift towards managing vast data collections, digital repositories, and innovative data analytics methods. The integration of artificial intelligence and its subset machine learning, has become pivotal in addressing all these challenges. This Roadmap on Data-Centric Materials Science explores fundamental concepts and methodologies, illustrating diverse applications in electronic-structure theory, soft matter theory, microstructure research, and experimental techniques like photoemission, atom probe tomography, and electron microscopy. While the roadmap delves into specific areas within the broad interdisciplinary field of materials science, the provided examples elucidate key concepts applicable to a wider range of topics. The discussed instances offer insights into addressing the multifaceted challenges encountered in contemporary materials research.

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Language(s): eng - English
 Dates: 2024-07-03
 Publication Status: Published online
 Pages: -
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 Table of Contents: -
 Rev. Type: -
 Identifiers: DOI: 10.1088/1361-651X/ad4d0d
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Title: Modelling and Simulation in Materials Science and Engineering
  Abbreviation : Modelling Simul. Mater. Sci. Eng.
Source Genre: Journal
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Publ. Info: London : IOP Pub.
Pages: - Volume / Issue: 32 (6) Sequence Number: 063301 Start / End Page: - Identifier: ISSN: 0965-0393
CoNE: https://pure.mpg.de/cone/journals/resource/954925581155