The pair (EquilibriumCrystalStructure_A2B_aP36_1_24a_12a_HO__TE_039698254090_002, Sim_LAMMPS_reaxFF_FthenakisPetsalakisTozzini_2022_CHON__SM_198543900691_000) did not produce a output/results.edn output file.