Hi all, I am running a geometry relaxation of a Cu2N@Cu(100) slab with a Fe atom on top, comprising 235 atoms - fixed cell, not variable cell.
All went well until at one point during the CG optimization, I got the following warning: WARNING: Connected supercells may have changed: [in]/[out] 21546/ 27702 WARNING: Connected supercells may have changed: [in]/[out] 21546/ 27702 WARNING: Connected supercells may have changed: [in]/[out] 15390/ 18468 WARNING: Connected supercells may have changed: [in]/[out] 21546/ 27702 WARNING: Connected supercells may have changed: [in]/[out] 15390/ 18468 WARNING: Connected supercells may have changed: [in]/[out] 15390/ 18468 Should I be worried? The calculation did not stop, and seemingly nothing bad happened. I will gladly supply any necessary further info. Best regards, Marcos
