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error in calculating raman.x #25

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nurwarrohman48 opened this issue Jan 2, 2025 · 0 comments
Open

error in calculating raman.x #25

nurwarrohman48 opened this issue Jan 2, 2025 · 0 comments

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@nurwarrohman48
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Hi,

I have finished with ph_mat.x calculation for 21 days. But after I run the Raman.x I got following error.

At line 156 of file raman_read.f90 (unit = 101, file = './CsPbBr3.dvec')
Fortran runtime error: Bad integer for item 2 in list input

Error termination. Backtrace:
#0 0x7f3503b93d11 in ???
#1 0x7f3503b94859 in ???
#2 0x7f3503b9553f in ???
#3 0x7f3503dceef3 in ???
#4 0x7f3503dd2179 in ???
#5 0x7f3503dd2db9 in ???
#6 0x557f8a2c8a33 in __raman_read_MOD_read_dvec
at /usr/local/bin/qe-7.3.1/QERaman/src/raman_read.f90:156
#7 0x557f8a2c0bae in raman
at /usr/local/bin/qe-7.3.1/QERaman/src/raman.f90:51
#8 0x557f8a2c023e in main
at /usr/local/bin/qe-7.3.1/QERaman/src/raman.f90:4

[1]+ Exit 2 raman.x < Raman.in > Raman.out

raman x error

could you help me to resolve that eror?

thank you

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