[QE-users] The virtual.x problems

Fabio Costa fabiocosta4 at hotmail.com
Sun Feb 24 23:41:44 CET 2019


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
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