Support and discussions for Molcas and OpenMolcas users and developers
You are not logged in.
Please note: The forum's URL has changed. The new URL is: https://molcasforum.univie.ac.at. Please update your bookmarks!
You can choose an avatar and change the default style by going to "Profile" → "Personality" or "Display".Pages: 1
Dear Molcas users,
I am trying some calculations and I am getting some errors. can anybody help me to solve this error?
Sogr| j= 3713 s1kk= -1.13146005289500053E-005
function has negative norm
--- Stop Module: seward at Wed Dec 20 14:18:17 2017 /rc= _INTERNAL_ERROR_ ---
--- Module seward spent 16 minutes and 18 seconds
Some internal inconsistency of the code was detected
Non-zero return code - check program input/output
--- Stop Module: auto at Wed Dec 20 14:18:19 2017 /rc= _INTERNAL_ERROR_ ---
--- Module auto spent 17 minutes and 5 seconds
Thank You
Offline
Pages: 1