Hi all,
I tried to run a calculation on Gaussian with the lanl2dz basic set as follow:
# opt=maxcycle=3000 freq=noraman lanl2dz int=ultrafine m06 scf=(novaracc,xqc,maxcycle=5000,conver=6)
I have a convergence failure problems. Please tell me how to fix these problems? Thanks in advanced.