RAS PresidiumВестник Российской академии наук Herald of the Russian Academy of Sciences

  • ISSN (Print) 0869-5873
  • ISSN (Online) 3034-5200

DIGITAL TECHNOLOGIES IN CHEMISTRY AND MATERIALS SCIENCE

PII
S0869587325040079-1
DOI
10.31857/S0869587325040079
Publication type
Article
Status
Published
Authors
Volume/ Edition
Volume / Issue number 4
Pages
35-38
Abstract
The article considers the problems and prospects of digitalization of chemical processes and technologies on the background of the global chemical landscape. Special attention is paid to such issues as low speed of data processing, the problem of lost data, knowledge transfer in micro- and low-tonnage chemistry technologies, and the digital cycle of chemical reaction production. Key areas are the application of specialized digital algorithms needed to solve specific problems in chemistry, accelerating data analysis, automating chemical research, creating new approaches to design materials for catalysis, and developing digital tools for science and educational programs. Important practical application is the use of artificial intelligence for scaling of chemical processes and technology transfer into industrial solutions.
Keywords
химия материаловедение цифровизация химических процессов и технологий обработка данных спящие и потерянные данные цифровой цикл проектирования химических реакторов микро- и малотоннажная химия
Date of publication
10.04.2025
Year of publication
2025
Number of purchasers
0
Views
19

References

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  2. 2. Ananikov V.P., Beletskaya I.P., Maksimov A.L., et al. Microtonnage and low-tonnage chemistry // Chemical expert. 2024, no. 4 (12), pp. 24-31. http://zioc.ru/preprint.012024v1
  3. 3. Eremin D.B., Galushko A.S., Boiko D.A. et al. Toward Totally Defined Nanocatalysis: Deep Learning Reveals the Extraordinary Activity of Single Pd/C Particles // J. Am. Chem. Soc. 2022, vol. 144, no. 13, pp. 6071-6079. https://doi.org/10.1021/jacs.2c01283
  4. 4. Galushko A.S., Boiko D.A., Pentsak E.O. et al. Time-Resolved Formation and Operation Maps of Pd Catalysts Suggest a Key Role of Single Atom Centers in Cross-Coupling // J. Am. Chem. Soc. 2023, vol. 145, no. 16, pp. 9092-9103. https://doi.org/10.1021/jacs.3c00645
  5. 5. Ananikov V.P. Top 20 influential AI-based technologies in chemistry // Art.Int.Chem. 2024, no. 2(2), 100075. https://doi.org/10.1016/j.aichem.2024.100075
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At the Ministry of Education and Science of the Russian Federation

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