Hello, I have successfully trained the model as required by https://github.com/mir-group/allegro-pol/, and then compiled LAMMPS successfully using https://github.com/mir-group/pair_nequip_allegro/tree/fix. However, I keep encountering this issue when running LAMMPS. How should I resolve
你好,我已经按照 https://github.com/mir-group/allegro-pol/ 的要求成功训练了模型,然后用 https://github.com/mir-group/pair_nequip_allegro/tree/fix 成功编译了 LAMMPS。然而,我在运行 LAMMPS 时一直遇到这个问题。我该如何解决
this? 这个?
