[CP2K:7227] Re: Solid State Structure Optimization
Samuel Andermatt
samuel.a... at student.ethz.ch
Wed Dec 9 13:47:00 UTC 2015
Ok, there seems to be a floating point exception in the construction of the
initial Hessian of BFGS. I currently do not know what the cause of this is.
In case I find something I will update you.
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