[QE-users] 回复: cannot find data-file-xml in cppp.x

Lu Hailin 415005271 at qq.com
Mon Jan 14 08:02:05 CET 2019


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
------------------ 原始邮件 ------------------
发件人: "Paolo Giannozzi"<p.giannozzi at gmail.com>;
发送时间: 2019年1月11日(星期五) 晚上6:51
收件人: "Quantum Espresso users Forum"<users at lists.quantum-espresso.org>;

主题: 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 <giuseppe.mattioli at ism.cnr.it> 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 <415005271 at qq.com> 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: <giuseppe.mattioli at ism.cnr.it>
 
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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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