scholarly journals Database, Features, and Machine Learning Model to Identify Thermally Driven Metal–Insulator Transition Compounds

Author(s):  
Alexandru B. Georgescu ◽  
Peiwen Ren ◽  
Aubrey R. Toland ◽  
Shengtong Zhang ◽  
Kyle D. Miller ◽  
...  
2021 ◽  
Vol 9 ◽  
Author(s):  
Jennifer Fowlie ◽  
Alexandru Bogdan Georgescu ◽  
Bernat Mundet ◽  
Javier del Valle ◽  
Philippe Tückmantel

In this perspective, we discuss the current and future impact of artificial intelligence and machine learning for the purposes of better understanding phase transitions, particularly in correlated electron materials. We take as a model system the rare-earth nickelates, famous for their thermally-driven metal-insulator transition, and describe various complementary approaches in which machine learning can contribute to the scientific process. In particular, we focus on electron microscopy as a bottom-up approach and metascale statistical analyses of classes of metal-insulator transition materials as a bottom-down approach. Finally, we outline how this improved understanding will lead to better control of phase transitions and present as an example the implementation of rare-earth nickelates in resistive switching devices. These devices could see a future as part of a neuromorphic computing architecture, providing a more efficient platform for neural network analyses – a key area of machine learning.


2014 ◽  
Vol 105 (13) ◽  
pp. 131902 ◽  
Author(s):  
Benjamin Huber-Rodriguez ◽  
Siu Yi Kwang ◽  
Will J. Hardy ◽  
Heng Ji ◽  
Chih-Wei Chen ◽  
...  

2004 ◽  
Vol 114 ◽  
pp. 277-281 ◽  
Author(s):  
J. Wosnitza ◽  
J. Hagel ◽  
O. Stockert ◽  
C. Pfleiderer ◽  
J. A. Schlueter ◽  
...  

2018 ◽  
Author(s):  
Steen Lysgaard ◽  
Paul C. Jennings ◽  
Jens Strabo Hummelshøj ◽  
Thomas Bligaard ◽  
Tejs Vegge

A machine learning model is used as a surrogate fitness evaluator in a genetic algorithm (GA) optimization of the atomic distribution of Pt-Au nanoparticles. The machine learning accelerated genetic algorithm (MLaGA) yields a 50-fold reduction of required energy calculations compared to a traditional GA.


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