[Wien] Lapw1(error)
Stefaan Cottenier
Stefaan.Cottenier at fys.kuleuven.be
Tue Apr 17 13:36:14 CEST 2007
1) Xcrysden is not meant to display a DOS (case.dos*) but for 3D-plots
of crystal structures, electron densities, etc.
2) Plotting a DOS is done either by the dosplot_lapw script (needs
gnuplot to be installed), or by any external software (windows or
linux) that can plot XY-graphs (excel, origin, sigmaplot, ....)
Stefaan
> Any one please can help me for graphical interface using XCRYSDEN. I
> have complete data file name case.dos1up but it it fails to plot the
> graph. Is another softwear is required in support or error with my data.
> when try to download post script format it gives error like
>
> File not found or temporary file does not exist any more
>
> In ./bashrc file the path is difind as
>
> #------------------------------------------------------------------------
> # this is for XCRYSDEN 1.4.1; added by XCRYSDEN installation on
> # Mon Apr 9 15:50:06 IST 2007
> #------------------------------------------------------------------------
> XCRYSDEN_TOPDIR=/root/Desktop/XCrySDen-1.4.1bin-shared
> XCRYSDEN_SCRATCH=/root/xcrys_tmp
> export XCRYSDEN_TOPDIR XCRYSDEN_SCRATCH
> PATH="$XCRYSDEN_TOPDIR:$PATH:$XCRYSDEN_TOPDIR/scripts:
> $XCRYSDEN_TOPDIR/util"
>
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>
--
Stefaan Cottenier
Instituut voor Kern- en Stralingsfysica
K.U.Leuven
Celestijnenlaan 200 D
B-3001 Leuven (Belgium)
tel: + 32 16 32 71 45
fax: + 32 16 32 79 85
e-mail: stefaan.cottenier at fys.kuleuven.be
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