[CPMD-list] "ODIIS| Insufficient progress; reset!"

[cdy2000 at vip.sina.com]

Hello,all CPMDer!

Thanks for Hutter's and HW Sheng's help.

Pinilla Castellanos Carlos has asked a question about "ODIIS| Insufficient progress; reset!" being in output file, someone give him two suggestions: a. a higher cutoff; b. using the keyword ODIIS NO_RESET=50. 

I met the same question, but the two methods is no useful to me. I want to know why and how to solve the question in other methods.

Thanks for any help.

Best regards

Sincerely               Cao Dayong
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