On 21/04/2025 16:27, BINOY CHANDRA DEY via users wrote:
Though the run was successful
it wasn't:
unfortunately, one of them, i.e., .xml, is not created at the output
directory
the xml file is created at the end of a run if successful (and maybe
even if it isn't), unless writing is explicitly disabled
Paolo
, and I could not go for further calculations. I have attached
the SCF input herewith the mail. Please look into it and let me know if
it is correct or not and needs any modification or not.
Sincerely,
Binoy
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Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 206, 33100 Udine Italy, +39-0432-558216
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The Quantum ESPRESSO Foundation stands in solidarity with all civilians
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