21–23 Jun 2023
Telegrafenberg
Europe/Berlin timezone

Neural network approach for stiff chemical mechanisms

22 Jun 2023, 16:45
1h
Building H (Telegrafenberg)

Building H

Telegrafenberg

Poster Deep/Machine learning and data science Poster Session

Speaker

Giorgio Salvatore Taverna (IMK-TRO)

Description

Computational efforts for the calculation of chemical reactions are about 30% of the total resource requested to run simulations involving climate models. Finding alternatives to speed up the calculation of the chemistry module is then a crucial task.
Recent studies show that the calculation of the Jacobian matrix is the most computationally demanding part of the related ODEs and then solutions have been sought to overcome this problem.
In this poster results from KPP and ICON-ART (in a box model version) for the stiff H2O2 chemistry and the air-pollution Verwer systems, compared with neural network corresponding results are shown. The H2O2 chemistry mechanism consists of 4 reactions (3 species), while the Verwer system is made of 25 reactions (21 species). The simulations have been initialized with a fixed and a random set of values. These results form the basis to subsequently train the neural network.

Primary author

Co-authors

Andrey Vlasenko (DKRZ) Prof. Björn-Martin Sinnhuber (KIT) David Solomon Greenberg (Helmholtz Centre Hereon) Gholamali Hoshyaripour (Institute of Meteorology and Climate Research (IMK), Karlsruhe Institute of Technology (KIT))

Presentation materials

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