| 6:12:58 AM PDT - Mon, Aug 20th 2018 |
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In order to save time, I changed tmax into 200, and found surely the calculation could finish with the input prepared by Dr. Silvio.pipolo using NWCHEM 6.8 on Ubuntu 17.10, e .g.,
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<rt_tddft>: 190.00000 4.685526608684E-001 -8.792965220763E+000 -1.304930976592E+001 # Dipole moment [system]
Grid integrated density: 20.000000210894
Requested integration accuracy: 0.10E-05
Grid integrated density: 20.000000210200
Requested integration accuracy: 0.10E-05
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<rt_tddft>: 190.20000 9.993624499245E-001 9.994081845749E-001 9.990054020206E-001 9.985851174490E-001 9.984522201957E-001 9.124872767608E-001 9.306509657535E-001 8.887214810717E-001 8.617506727172E-001 7.215396190989E-001 7.991670745015E-001 7.667270511842E-001 7.296574573087E-001 8.245064003777E-001 6.902703919876E-001 5.561729852632E-001 5.856462066806E-001 7.241157618979E-001 5.423422602323E-001 3.464949726962E-001 1.379533583290E-001 2.553622996966E-001 2.627312335724E-001 1.529924110596E-001 2.812978426880E-001 9.471734367803E-002 7.248516468705E-002 8.942116558787E-002 5.218889158904E-002 1.575479141555E-001 5.983821032709E-002 1.269395268988E-001 1.099449068983E-001 9.892788277884E-002 2.055072843457E-001 1.297101367768E-001 7.026130555491E-002 1.031315214103E-001 5.462062447562E-002 1.375530980558E-001 8.251724204817E-002 6.451203733198E-002 4.780401790225E-002 6.041824198189E-002 5.231697098799E-002 6.345218512342E-002 7.135222985984E-002 4.119921015193E-002 7.615780234096E-002 4.081856417814E-002 7.022881885275E-002 8.610666068907E-002 4.395549591596E-002 5.231894748590E-002 5.122021402050E-002 6.041350581402E-002 4.145597868083E-002 4.282752778037E-002 3.890703739468E-002 5.109787085925E-002 3.632495991858E-002 1.557546496810E-002 1.003727405984E-001 8.657899896340E-003 1.116789654714E-002 1.080764683430E-002 1.297845613371E-002 1.310236454753E-002 7.303367005528E-003 1.875116844280E-002 1.244670778984E-002 6.374072646304E-003 1.052794652187E-002 7.148581421069E-003 8.940435576026E-003 5.984235327893E-003 5.914335522488E-003 8.969417435934E-003 7.791382708912E-003 4.419131569486E-003 4.090931520379E-003 3.640693958260E-003 5.115504034505E-003 3.572333178682E-003 2.745692365302E-003 # MO Occupations
<rt_tddft>: 190.20000 4.248913257769E-001 -8.903716240706E+000 -1.296232588479E+001 # Dipole moment [system]
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<rt_tddft>: 199.80000 ### Propagation finished ###
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I have not tried the original input with the visualization set.
There is also no problem for Dr.Govind's closed-shell example to be successful, e.g.,
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kickx 198.00000 -1.133347095243E-004 -2.844175674034E-006 6.777161352689E-002 # Dipole moment [system]
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kickx 199.80000 ### Propagation finished ###
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