Hello It's most likely a bug, hopefully one of those that were fixed in the newer versions. Regards - Pietro
Il 6 feb 2023 9:20 AM, "Mr. Sheharyar Pervez RA FES" <shehar...@giki.edu.pk> ha scritto: When running an scf calculation on QE 6.4.1, I get the following from FoX: ERROR(FoX) xml_AddCharacters: Invalid character in chars The calculation runs fine but no xml file is generated. the following files are created: . ├── kgec.in ├── qmof-f2ae0a5.save │ ├── charge-density.dat │ ├── data-file-schema.xml │ └── paw.txt ├── qmof-f2ae0a5_scf.in ├── qmof-f2ae0a5_scf.out └── qmof-f2ae0a5.wfc1 I'm not sure where this invalid character comes from because the entire input file is in standard ascii format. How to go about solving this?
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