Dear Paolo,
Thank you so much for reply.
the question will be solved if I use the version 6.1?
Thank you!
Best regards,
------
LU Hailin, Graduate Student
State Key Laboratory of Mechanical Transmission, Chongqing University
Chongqing 400044, China
Tel: (+86) 18362360286
------------------ ???????? ------------------
??????: "Paolo Giannozzi"<[email protected]>;
????????: 2019??1??11??(??????) ????6:51
??????: "Quantum Espresso users Forum"<[email protected]>;
????: Re: [QE-users] cannot find data-file-xml in cppp.x
It is still possible to use the old format (recompiling with preprocessing
option -D__OLDXML) but this will disappear for good from next versions
Paolo
On Fri, Jan 11, 2019 at 10:40 AM Giuseppe Mattioli
<[email protected]> wrote:
Dear Lu Hailin
AFAIK, cp.x has been aligned with pw.x in version 6.3 and performs I/O
tasks by using the new xml format. cppp.x has been kept back to the
older format because unfortunately nobody has been finding the time to
update it.
HTH
Giuseppe
Lu Hailin <[email protected]> ha scritto:
> Dear all,
>
>
>
> I use Quantum Espresso 6.3. version on Linux, which gives
> "data-file-schema.xml" file in .save folder after calculations,
>
> however, what I need is "data-file.xml" file,which was used in
> previous versions.
>
> Then the error was occured ,which showed that the file cannot be opened.
>
> The"outdir" variable in the input file shows the route of
> "data-file-schema.xml" file ,which can be opened,while not.
>
> therefore,I think is there any wrong with the cppp.x code or it was
> caused by the version.
>
> Is there any solution that might do the trick?
> Thank you!
> Best regards,
>
>
>
> ------
>
> LU Hailin, Graduate Student
>
> State Key Laboratory of Mechanical Transmission, Chongqing University
>
>
>
> Chongqing 400044, China
>
> Tel: (+86) 18362360286
GIUSEPPE MATTIOLI
CNR - ISTITUTO DI STRUTTURA DELLA MATERIA
Via Salaria Km 29,300 - C.P. 10
I-00015 - Monterotondo Scalo (RM)
Mob (*preferred*) +39 373 7305625
Tel + 39 06 90672342 - Fax +39 06 90672316
E-mail: <[email protected]>
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--
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
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