[Pw_forum] xml file format control

Paolo Giannozzi giannozz at democritos.it
Tue Oct 7 08:24:37 CEST 2008


yumin qian wrote:

>  the output file of charge density is suffix.dat , it's a binary file .
>  and the wave function file is suffix.wfcx  is also a binary file.
>  but the file contains the system info is data-file.xml , my question 
>  is how to set input parameter to make the out put files of wavefuntion
>  and charge density in xml format. 

formatted xml? you can't: you have to modify the code where it
reads and writes the data files. It is not a great idea, though:
binary files are much smaller than formatted files

Paolo
-- 
Paolo Giannozzi, Democritos and University of Udine, Italy



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