Dear all,
I am using turbomole 7.0, and I would like to employ M06-L functional for my calculations. I tried to add a few lines to the control file as follows
$dft
functional xcfun set-mgga
functional xcfun m06lx 1.0
functional xcfun m06lc 1.0
But it is not possible to run the calculation.
Can any one tell me the exact way to use XCFUN and give me a typical example?
Thanks in advance,
Nahn.