A review of recent progress in thermoelectric materials through computational methods
Sign Up to like & getrecommendations! Published in 2020 at "Materials for Renewable and Sustainable Energy"
DOI: 10.1007/s40243-020-00175-5
Abstract: Reducing our overwhelming dependence on fossil fuels requires groundbreaking innovations in increasing our efficiency in energy consumption for current technologies and moving towards renewable energy sources. Thermoelectric materials can help in achieving both goals. Moreover,… read more here.
Keywords: progress thermoelectric; thermoelectric materials; review recent; computational methods ... See more keywords
Hard and superhard materials: A computational perspective
Sign Up to like & getrecommendations! Published in 2019 at "Journal of Solid State Chemistry"
DOI: 10.1016/j.jssc.2018.10.048
Abstract: Abstract Hard and superhard materials are essential for a myriad of scientific, biomedical, and industrial applications. Their ability to resist indentation stems from the relationship between the crystal structure, chemical composition, and microstructure. The complexity… read more here.
Keywords: superhard materials; length scales; materials computational; computational perspective ... See more keywords
Computational Investigation of Large-Diameter Carbon Nanotubes in Bundles for High-Strength Materials
Sign Up to like & getrecommendations! Published in 2020 at "ACS Applied Nano Materials"
DOI: 10.1021/acsanm.0c01462
Abstract: Carbon nanotube aerogels are interesting platforms for the manufacture of lightweight composites. To guide the development, we screen with tight-binding atomistic calculations two primary crystalline organizations of nanotubes with 1.4–4.5 nm radii and 1–3 number… read more here.
Keywords: large diameter; carbon; diameter carbon; computational investigation ... See more keywords