When i tried to calculate elastic constant using IRelast. i was getting error below in my WIEN2k 19.2 package installed in my workstation with ubuntu OS. Below is the error message i am gettting while running the command 'set_elast_pressure'.
E=E0+[B*V/BP*(1/(BP-1)*(V0/V)**BP +1)-B*V0/(BP-1)]
E
Read data from line 8 ....
At line 83 of file calLa_Pre_elast.f (unit = 10, file = 'MgO.outputeos')
Fortran runtime error: Constant string in input format
(' V0,B(GPa),BP,E0',3f15.4,f18.6)
^
Error termination. Backtrace:
#0 0x154aa00e932a
#1 0x154aa00e9ed5
#2 0x154aa00ea69d
#3 0x154aa0253cb1
#4 0x154aa0262101
#5 0x154aa026372c
#6 0x154aa02642d2
#7 0x55d47934d7ef
#8 0x55d47934cd7e
#9 0x154a9f960c86
#10 0x55d47934cdb9
#11 0xffffffffffffffff
cp: cannot stat 'init.struct': No such file or directory
(C)by Morteza Jamal
(2014)
***** * * ******
* * * *
* * * ******
* * * *
***** * * ******
#######################################
# set_elast_lapw
#######################################
# C_set_elast_lapw prepares #
# Directories and job files. #
# C(2017) by Morteza Jamal #
# it creates c11+2c12, #
# c11-c12, and c44 directories #
# and CUBIC.job file #
# in them #
# which must be executed #
# and can be analyzed by #
# C_ana_elast_lapw #
#######################################
cp: -r not specified; omitting directory '../../MgO/.'
cp: -r not specified; omitting directory '../../MgO/..'