You signed in with another tab or window. Reload to refresh your session.You signed out in another tab or window. Reload to refresh your session.You switched accounts on another tab or window. Reload to refresh your session.Dismiss alert
Report if the calculation converged - either electronic or ionic convergence. Could be useful for high-throughput studies and eventual error handling. With the slice operator, this feature could tell if one or more ionic steps did not reach SCF convergence.
The text was updated successfully, but these errors were encountered:
Report if the calculation converged - either electronic or ionic convergence. Could be useful for high-throughput studies and eventual error handling. With the slice operator, this feature could tell if one or more ionic steps did not reach SCF convergence.
The text was updated successfully, but these errors were encountered: