iRASPA Community

iRASPA => General => Topic started by: Mohammad Ahmadi on June 09, 2022, 03:33:54 PM

Title: reinsertion move used on charged ions
Post by: Mohammad Ahmadi on June 09, 2022, 03:33:54 PM
Hi Dear Prof. Dubbeldam
How I can resolve this warning:
REINSERTION MOVE USED ON CHARGED IONS (IF POSSIBLE, CHANGE TO RANDOM TRANSLATION MOVE TO AVOID NUMERICAL PROBLEMS)