Yuxing Zhou

Thanks for the quick reply @srmnitc. I followed the installation introduction from the website: (1) `git clone https://github.com/ICAMS/calphy.git`; (2) `cd calphy` and `conda env create -f environment.yml`; (3) `conda activate...

Thanks for help! The update of pylammpsmpi to 0.2.13 indeed helps wake up the lammps. However, there is still now any output from LAMMPS and I received another error in...

Sorry for the late response. This is what calphy.log looks like in one of my calphy calculations. ``` 2024-02-26 20:45:24,878 calphy.helpers INFO ---------------input file---------------- 2024-02-26 20:45:24,879 calphy.helpers INFO commented out...

Sure! The version of mpi4py is 3.1.4 in my conda environment