Hello everybody Sorry for reopening this post, but Im currently struggling to work with this virtual.x tool.
I'm working with QE v.6.3, and tried to do the task with both the updated and original version of virtual.x. After inputting the PP to mix together, the program generates the output file, but ends with the message: At line 215 of file write_upf_v2.f90 Fortran runtime error: End of file Also, when I open the output PP, NewPseudo.UPF, it contains the following text: <?xml version "1.0" encoding="UTF-8"?> <UPF version="2.0.1"> Thank you all for any assistance Cheers Fábio Costa
_______________________________________________ users mailing list users@lists.quantum-espresso.org https://lists.quantum-espresso.org/mailman/listinfo/users