me = 0 Eigenvector 17 failed to convergve in inv it3

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me = 0 MAXITS exceeded in inv_it

c1= 16 cn= 17 b1= 16 bn = 17
nrm = 1.09127 stpcrt = 1.11803
xj = 1.000000e+00 onenrm = 1.000000e+00
d[16] = 1.000000e+00 e[16] = -8.831975e-17
d[17] = 1.000000e+00 e[17] = -1.779574e-16

me = 0 Eigenvector 17 failed to convergve in inv_it3

Error in pdspevx. me = 0 pstein returned info = 18
Error in pdspevx. me = 2 pstein returned info = 18
Error in pdspevx. me = 1 pstein returned info = 18
Error in pdspevx. me = 3 pstein returned info = 18
Error in pdspevx. me = 4 pstein returned info = 18
Error in pdspevx. me = 5 pstein returned info = 18
Error in pdspevx. me = 7 pstein returned info = 18
Error in pdspevx. me = 6 pstein returned info = 18

I am trying to do direct dynamics with VENUS-NWCHEM.I increased the iterations values, but its giving the same error

Regards

Yoge


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