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Accelerating materials discovery for polymer solar cells: data-driven insights enabled by natural language processing
We present a simulation of various active learning strategies for the discovery of polymer
solar cell donor/acceptor pairs using data extracted from the literature spanning∼ 20 years …
solar cell donor/acceptor pairs using data extracted from the literature spanning∼ 20 years …
Designing workflows for materials characterization
Experimental science is enabled by the combination of synthesis, imaging, and functional
characterization organized into evolving discovery loop. Synthesis of new material is …
characterization organized into evolving discovery loop. Synthesis of new material is …
Discovering optimal flap** wing kinematics using active deep learning
This paper focuses on the discovery of optimal flap** wing kinematics using a deep
learning surrogate model for unsteady aerodynamics and multi-objective optimisation. First …
learning surrogate model for unsteady aerodynamics and multi-objective optimisation. First …
Active learning for neural pde solvers
D Musekamp, M Kalimuthu, D Holzmüller… - ar** efficient methods to find materials that satisfy multiple properties simultaneously
is an important task so that the material screening process can be accelerated with reduced …
is an important task so that the material screening process can be accelerated with reduced …
Artificial intelligence for materials research at extremes
Materials development is slow and expensive, taking decades from inception to fielding. For
materials research at extremes, the situation is even more demanding, as the desired …
materials research at extremes, the situation is even more demanding, as the desired …
Targeted materials discovery using Bayesian algorithm execution
Rapid discovery and synthesis of future materials requires intelligent data acquisition
strategies to navigate large design spaces. A popular strategy is Bayesian optimization …
strategies to navigate large design spaces. A popular strategy is Bayesian optimization …