Dear QE Users and Developers, I am doing a "relax" calculation using QE-7.1 with "ibrav=0" giving explicitly the values for CELL_PARAMETERS. After the first scf, I get the error message:
ERROR(FoX) xml_AddAttribute: Invalid character in value I googled for this message and found the following post with no solutions: > Changing calculation from “scf” to “relax” in the test produce the error for me, do you have it too? no ... at least not for v.7.0. There were a few glitches with "non-standard" values of ibrav but I am quite sure all of them were fixed before v.7.1 was released Paolo Any comments is highly appreciated. Bests, Mahmoud Payami NSTRI, AEOI, Tehran, Iran Email: [email protected] Phone: +98 (0)21 82066504 --------------------------------------- Mahmoud Payami Professor of Physics Theoretical & Computational Physics Group Physics & Accelerators Research School NSTRI, AEOI, Tehran, Iran Email: [email protected] Phone: +98 (0)21 82066504 --------------------------------------------------------
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