BSE wrong dimension error
Posted: Fri Dec 08, 2017 3:21 pm
Hello,
I am experiencing the following error when I do BSE calculations with model dielectric function. I am using the direct diagonalization method. Anyone knows how to solve the problem?
--- !ERROR
src_file: m_exc_diago.F90
src_line: 784
mpi_rank: 0
message: |
Wrong dimension: read: 964050190 expected= 128
...
leave_new: decision taken to exit ...
My input file is:
optdriver 99
irdwfk 1
bs_calctype 1
mbpt_sciss 1.05 eV
bs_exchange_term 1
bs_coulomb_term 20
bs_coupling 0
bs_loband 45
nband 47
bs_freq_mesh 0 5 0.02 eV
bs_algorithm 1
zcut 0.15 eV
kptopt 1
ngkpt 4 4 4
nshiftk 1
shiftk 0.0 0.0 0.0
ecutwfn 40.0
ecuteps 5.0
inclvkb 2
icutcoul 3
ecut 40
istwfk *1
mdf_epsinf 3.4
[crystal info]
I am experiencing the following error when I do BSE calculations with model dielectric function. I am using the direct diagonalization method. Anyone knows how to solve the problem?
--- !ERROR
src_file: m_exc_diago.F90
src_line: 784
mpi_rank: 0
message: |
Wrong dimension: read: 964050190 expected= 128
...
leave_new: decision taken to exit ...
My input file is:
optdriver 99
irdwfk 1
bs_calctype 1
mbpt_sciss 1.05 eV
bs_exchange_term 1
bs_coulomb_term 20
bs_coupling 0
bs_loband 45
nband 47
bs_freq_mesh 0 5 0.02 eV
bs_algorithm 1
zcut 0.15 eV
kptopt 1
ngkpt 4 4 4
nshiftk 1
shiftk 0.0 0.0 0.0
ecutwfn 40.0
ecuteps 5.0
inclvkb 2
icutcoul 3
ecut 40
istwfk *1
mdf_epsinf 3.4
[crystal info]