Hi
Does anybody know about this error;
ERROR ROTDIA: Call to routine ZHEEV failed! Error code was 95
This is a B3LYP calculation. The calculation starts with no problem but before completing the fırst ionic loop it stops with this error.
Mnay thanks
B3LYP error
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ccccc
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B3LYP error
Last edited by ccccc on Tue Nov 12, 2013 12:56 am, edited 1 time in total.
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support_vasp
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Re: B3LYP error
Hi,
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