Dear CCLers,
I have been tring to obtain magnetic shielding constants to TMS with
bellow Route Section:
#T MP2=Semidirect/GEN NMR SCF=Direct Transformation=Semidirect
I am using Ahlrich pTZV basis set but the Gaussian 98 stop, with
error in the Link L906 and write:
"Discarding MO integrals
File extend in NtrExt1 Failed"
Why this error if the job is Semidirect?
Thanks for any Help!
Best Regards!
Sidney Ramos
DQF - CCEN - UFPE