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Structure Modeling and Property Calculations of Amorphous Materials
(2019-05-16)
The demand in discovery of novel materials for a seemingly infinite list of applications is growing year by year. Even though it’s not uncommon to find the application for the material after its discovery upon experimentally ...
Computational materials chemistry: from polymer precursors to ceramics and high-pressure materials
(2022-08-17)
With advances in computing power, the field of computational chemistry has flourished. Using current computational resources, atomistic simulations of billion atoms and trillions of atoms have been performed. Computational ...