Input script and processed data from CMS2021. in.nvtcac is a constant-shear stress template input file.
We use a fork of LAMMPS: https://github.com/kvnchv/lammps/tree/USER-CAC
If the dataset or input files are used in any form, please cite: Chu, K., Diaz, A., Chen, Y., Zhu, T. & McDowell, D. L. Multiscale Concurrent Atomistic-Continuum (CAC) modeling of multicomponent alloys. Computational Materials Science 201, 110873 (2022). https://doi.org/10.1016/j.commatsci.2021.110873