[Wien] Problem in Band Structue plot in wien2k
vivek jain
vivek.jain129 at gmail.com
Sat Aug 17 12:04:31 CEST 2013
Dear Sir,
I am running wien2k version on Ubuntu system.
i am calculating for band structure of Mn2FeZ heusler alloys using PBE-GGA
96 approximation, Rmt*Kmax = 7.0
i give k-mesh point = 48
X lapw1 band up & down calculation successfully run. but when using
Commandline: *x spaghetti -up following problem occured.*
Commandline: *x spaghetti -up *
Program input is: *""*
number of k-points read in case.vector= 111
forrtl: severe (59): list-directed I/O syntax error, unit 5, file
/home/nrl/WIEN2k/Mn2FeZ/Mn2FeSi/Mn2FeSi.insp
Image PC Routine Line Source
spaghetti 080CECCF Unknown Unknown Unknown
spaghetti 080CD9C5 Unknown Unknown Unknown
spaghetti 080A94F1 Unknown Unknown Unknown
spaghetti 0809630E Unknown Unknown Unknown
spaghetti 08095B92 Unknown Unknown Unknown
spaghetti 08076956 Unknown Unknown Unknown
spaghetti 08055B89 inview_ 32 inview.f
spaghetti 0805B6D2 MAIN__ 363 spag.f
spaghetti 0804A104 Unknown Unknown Unknown
libc.so.6 400A44D3 Unknown Unknown Unknown
0.0u 0.0s 0:00.02 100.0% 0+0k 0+48io 0pf+0w
error: command /home/nrl/WIEN2k/spaghetti upspaghetti.def failed
Continue with
--
Warm Regards,
Vivek Kumar Jain
09413635180
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