How to increase the number of maximum cycles in gaussian 03 software ( windows mode) for excited state optimisation?
In the calculation step , the increasing no of N will leads to enhancement of no of states
If I got it properly, u need to increase the scfcycle as
write
scf=maxcycle=2024
in the '.com' file just after opt basis_set
include maxcyc=n in the rout sentence as op=maxcyc=n but in case of scf iteration, use scf=maxcyc=n
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