Deep dive into machine learning density functional theory for materials science and chemistry
With the growth of computational resources, the scope of electronic structure simulations has
increased greatly. Artificial intelligence and robust data analysis hold the promise to …
increased greatly. Artificial intelligence and robust data analysis hold the promise to …
Digital twin: Values, challenges and enablers from a modeling perspective
Digital twin can be defined as a virtual representation of a physical asset enabled through
data and simulators for real-time prediction, optimization, monitoring, controlling, and …
data and simulators for real-time prediction, optimization, monitoring, controlling, and …
Mg3 (Sb, Bi) 2-based materials and devices rivaling bismuth telluride for thermoelectric power generation and cooling
Summary Mg 3 (Sb, Bi) 2-based compounds have recently attracted much attention
regarding possible technological implementation due to their high thermoelectric (TE) …
regarding possible technological implementation due to their high thermoelectric (TE) …
Digital twin: Values, challenges and enablers
A digital twin can be defined as an adaptive model of a complex physical system. Recent
advances in computational pipelines, multiphysics solvers, artificial intelligence, big data …
advances in computational pipelines, multiphysics solvers, artificial intelligence, big data …
Data-driven enhancement of ZT in SnSe-based thermoelectric systems
Doping and alloying are fundamental strategies to improve the thermoelectric performance
of bare materials. However, identifying outstanding elements and compositions for the …
of bare materials. However, identifying outstanding elements and compositions for the …
Review on nanofluids and machine learning applications for thermoelectric energy conversion in renewable energy systems
D Okulu, F Selimefendigil, HF Öztop - Engineering Analysis with Boundary …, 2022 - Elsevier
This review is about applications of nanofluids technology and different machine learning
algorithms on the potential improvement of system performance and computational …
algorithms on the potential improvement of system performance and computational …
Predicting thermoelectric transport properties from composition with attention-based deep learning
LM Antunes, KT Butler… - … Learning: Science and …, 2023 - iopscience.iop.org
Thermoelectric materials can be used to construct devices which recycle waste heat into
electricity. However, the best known thermoelectrics are based on rare, expensive or even …
electricity. However, the best known thermoelectrics are based on rare, expensive or even …
[HTML][HTML] Data-driven thermoelectric modeling: Current challenges and prospects
MT Mbaye, SK Pradhan, M Bahoura - Journal of Applied Physics, 2021 - pubs.aip.org
Recent advancements in computing technologies coupled with the need to make sense of
large amounts of raw data have renewed much interest in data-driven materials design and …
large amounts of raw data have renewed much interest in data-driven materials design and …
Towards tailored thermoelectric materials: An artificial intelligence-powered approach to material design
The pursuit of novel thermoelectric (TE) materials with exceptional properties stands as a
critical frontier in material science. This transformative endeavor demands a paradigm shift …
critical frontier in material science. This transformative endeavor demands a paradigm shift …
Accelerated discovery of thermoelectric materials using machine learning
Optimized electronic and thermal transport properties are the key requirements for the
discovery of efficient thermoelectric materials. Owing to the complex interdependence …
discovery of efficient thermoelectric materials. Owing to the complex interdependence …