[QE-users] ibrav = -12 xml error

[Tom Demeyere]

"test-suite/lattice-ibrav-12.in contains ibrav=-12 but does not produce
such a message”

Changing calculation from “scf” to “relax” in the test produce the error for me, do you have it too?

Best regards,
Tom Demeyere



> On 9 Oct 2022, at 17:44, Paolo Giannozzi <paolo.giannozzi at uniud.it> wrote:
> 
> CAUTION: This e-mail originated outside the University of Southampton.
> 
> test-suite/lattice-ibrav-12.in contains ibrav=-12 but does not produce
> such a message
> 
> Paolo
> 
> On 09/10/2022 18:27, Tom Demeyere wrote:
>> Dear Paolo,
>> 
>> I tried 7.1 and 7.0
>> 
>> Best regards,
>> Tom Demeyere
>> 
>> 
>> 
>>> On 9 Oct 2022, at 17:12, Paolo Giannozzi <paolo.giannozzi at uniud.it> wrote:
>>> 
>>> CAUTION: This e-mail originated outside the University of Southampton.
>>> 
>>> On 09/10/2022 16:36, Tom Demeyere wrote:
>>> 
>>>> I get this message in stderr:
>>>> 
>>>> ERROR(FoX)
>>>> xml_AddAttribute: Invalid character in value
>>>> 
>>>> When using ibrav = -12
>>> 
>>> for which code version?
>>> 
>>> Paolo
>>> --
>>> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
>>> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
>>> Phone +39-0432-558216, fax +39-0432-558222
>> 
> 
> --
> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222