[Wien] error in plotting electron density

Farshad Nejadsattari fneja083 at uottawa.ca
Wed Feb 26 21:18:06 CET 2014


Dear Wien2k users and Developers,

  I am working on the compound FeNiSn and when I try to plot the electron
density for spin up, at the x lapw -up stage I receive this error:

Commandline: x lapw2 -all -1.0 1.0 -up -so
Program input is: " "
forrtl: severe (24): end-of-file during read, unit 30, file
/home/hpc2768/lapw/new/new.energysoup
Image              PC                Routine            Line
Source
lapw2c             000000000053AE0A  Unknown               Unknown  Unknown
lapw2c             0000000000539906  Unknown               Unknown  Unknown
lapw2c             00000000004F41A0  Unknown               Unknown  Unknown
lapw2c             00000000004B14AE  Unknown               Unknown  Unknown
lapw2c             00000000004B09EF  Unknown               Unknown  Unknown
lapw2c             00000000004CE0A6  Unknown               Unknown  Unknown
lapw2c             0000000000434C5E  fermi_                     43
fermi_tmp_.F
lapw2c             0000000000475853  MAIN__                    296
lapw2_tmp_.F
lapw2c             0000000000403DCC  Unknown               Unknown  Unknown
libc.so.6          0000003142A1D9C4  Unknown               Unknown  Unknown
lapw2c             0000000000403CD9  Unknown               Unknown  Unknown
0.067u 0.012s 0:00.10 70.0% 0+0k 0+0io 0pf+0w
error: command   /u1/work/hpcg1444/WIEN2K/test-build/lapw2c uplapw2.def
failed

your guidance and help is truly appreciated

Farshad Nejadsattari
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