其实只需要修改一处，解决全部报错。reaxff不需要设置bond_style，删除分子模板mol.txt里关于键的所有描述

报错汇总

超算，sc54074，1节点（64核），lammps stable 2021

ERROR on proc 6: Bond atom missing in box size check

The second atom needed to compute a particular bond is missing on this processor. Typically this is because the pairwise cutoff is set too short or the bond has blown apart and an atom is too far away.

实验室小机器，deepin，4核，lammps stable 2022

WARNING: Using a manybody potential with bonds/angles/dihedrals and special_bond exclusions (../pair.cpp:239)

This is likely not what you want to do. The exclusion settings will eliminate neighbors in the neighbor list, which the many-body potential needs to calculated its terms correctly.

WARNING: Bonds are defined but no bond style is set (../force.cpp:192)

The topology contains bonds, but there are no bond forces computed since there was no bond_style command.

WARNING: Likewise 1-2 special neighbor interactions != 1.0 (../force.cpp:194)

The topology contains bonds, but there is no bond style defined and a 1-2 special neighbor scaling factor was not 1.0. This means that pair style interactions may have scaled or missing pairs in the neighbor list in expectation of interactions for those pairs being computed from the bond style.

ERROR on proc 1: Bond atom missing in image check

The second atom in a particular bond is missing on this processor. Typically this is because the pairwise cutoff is set too short or the bond has blown apart and an atom is too far away.