Kyuhyun Lee,
Dongsun Yoo,
Wonseok Jeong,
Seungwu Han,
Version 0 of Colab Fit Dataset published 2023 via ColabFit
10,000 configurations of SiO2 used as an example for the SIMPLE-NN machine learning model. Dataset includes three types of crystals: quartz, cristobalite and tridymite; amorphous; and liquid phase SiO2. Structures with distortion from compression, monoaxial strain and shear strain were also included in the training set.