Hi Camps, See, I know nothing about your system and never done calculations with VdW pseudos. However I noticed that the cut off radius of your f basis function for Co is about twice the shortest edge of your box ... this calling for troubles I think.
Best, Roberto On 08/27/2013 03:49 PM, I. Camps wrote:
Hello SIETers, I am running a SIESTA calculation for a CoO2 using van der Waals (siesta-trunk-433) The input, pseudopotentials and log (for serial run) are attached. When running in parallel, I got the following error message at the end of the log: siesta APPLICATION TERMINATED WITH THE EXIT STRING: Segmentation fault (signal 11) Googling, I read abut this been a MPI problem, so I run in serial. When running in serial, SIESTA stopped without any message. I appreciate any help with this issue. []'s, @mps
