Load of old vectors failed

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  • Bert Forum:Admin, Forum:Mod, NWChemDeveloper, bureaucrat, sysop
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At this point in your caluclation lindep should not help you, only if you start a new simulation. I can only suggest starting with the latest geometry and without the old vectors.


Quote:Chloe Sep 19th 1:43 pm
Thanks Bert, but "set lindep" doesn't work. I have a feeling it has more to do with the warning about the basis mismatch than the linear dependence.

By the way, I was using the geometry from the last step as the input geometry.


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