Dear all, I'm trying to perform a "vc-relax" calculation using the tetrahedron method with QE v 6.1.
The calculation stops after having printed the final geometry, during the final scf step. It does not write any error and the scheduler only reports a segmentation fault. I have tried with both tetrahedra and tetrahedra_opt, but I have the same issue. The problem is not there if I do a "relax" calculation. Please find attached, the input and output of an example. Thanks in advance! Regards, Chiara Ricca --- Postdoctoral fellow University of Bern
BaTiO3.in
Description: BaTiO3.in
BaTiO3.6.1.out
Description: BaTiO3.6.1.out
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