Position Paper on Materials Design -- A Modern Approach

التفاصيل البيبلوغرافية
العنوان: Position Paper on Materials Design -- A Modern Approach
المؤلفون: Grossmann, Willi, Eilermann, Sebastian, Rensmeyer, Tim, Liebert, Artur, Hohmann, Michael, Wittke, Christian, Niggemann, Oliver
سنة النشر: 2023
المجموعة: Computer Science
Condensed Matter
مصطلحات موضوعية: Condensed Matter - Materials Science, Computer Science - Artificial Intelligence, Computer Science - Machine Learning
الوصف: Traditional design cycles for new materials and assemblies have two fundamental drawbacks. The underlying physical relationships are often too complex to be precisely calculated and described. Aside from that, many unknown uncertainties, such as exact manufacturing parameters or materials composition, dominate the real assembly behavior. Machine learning (ML) methods overcome these fundamental limitations through data-driven learning. In addition, modern approaches can specifically increase system knowledge. Representation Learning allows the physical, and if necessary, even symbolic interpretation of the learned solution. In this way, the most complex physical relationships can be considered and quickly described. Furthermore, generative ML approaches can synthesize possible morphologies of the materials based on defined conditions to visualize the effects of uncertainties. This modern approach accelerates the design process for new materials and enables the prediction and interpretation of realistic materials behavior.
Comment: This paper has been accepted for publication at the AAAI 2024 Workshop on AI to Accelerate Science and Engineering
نوع الوثيقة: Working Paper
URL الوصول: http://arxiv.org/abs/2312.10996
رقم الأكسشن: edsarx.2312.10996
قاعدة البيانات: arXiv