[Wien] SCF with force convergence

Chandrika rcais at cal3.vsnl.net.in
Fri May 6 11:49:02 CEST 2005


Hello Wien users,
When I run SCF with the option force convergence I get an error message "Force convergence not possible. Forces not present". With other (charge & energy) options SCF works okay.
Could you suggest where I might have gone wrong?
Thanks in advance
Chandrika
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