Hi Uwe,
I'm trying to do a tm2molden option for visualisation of vibrationes in molden.
I get the following errors. I use a basis set for lanthanide with g function.
But T 5.10 supports g functions. But i really dont know why does this error occurs.
Can you please help me this.
Thanks.
Muthu
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number of unique ecp types : 1
symmetry group of the molecule : c2v
the group has the following generators : c2(z)
mirror plane sigma(xz)
4 symmetry operations found
there are 4 real representations : a1 a2 b1 b2
1971 is greater than mxsao=(ndi4*ndi19)= 1970 - use higher ndi19 !
MODTRACE: no modules on stack
<maksao> sao/ao dimension overflow
tm2molden ended abnormally
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