cdc221144

I enumerated the structures in the specified range, and then failed to submit.

1

Hello, I failed to submit the calculation after enumerating the structures with the specified range. Can casm optimize the structures with the specified atomic number? Here are the commands I...

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

1

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...