All 630 structures have been calculated to run.final, but only 445 structures are found when the formation energy is extracted.

[cdc221144]

Hello, I calculated 631 structures, of which 630 were calculated to run.final, but only 445 were finally calculated to formation energy. When the updated data is optimized, the following information appears, **WARNING: Could not map 59 results. See detailed report: "/home/chendechuang/data/MoTa/reports/update_report.2/update_config_fail"

Successfully mapped 571 results. See detailed report: "/home/chendechuang/data/MoTa/reports/update_report.2/update_config_success"

WARNING: Found 240 conflicting relaxation results. See detailed report: "/home/chendechuang/data/MoTa/reports/update_report.2/update_config_conflict"

WARNING: Found 161 unstable relaxations. See detailed report: "/home/chendechuang/data/MoTa/reports/update_report.2/update_config_unstable"

Set reference states automatically.** Thank you very much for your help.

[bpuchala]

When CASM reads in calculated structures it attempts to map the relaxed lattice vectors and atom coordinates to the prim. "Failed" means no reasonable mapping could be found, indicating the structures relaxed to some other primitive crystal structure (BCC to HCP for example). "Unstable" means the relaxed structure did not map back to the configuration it started at. "Conflict" means multiple structures mapped to the same configuration.