[Pw_forum] compilation problem

bhabya sahoo bdslipun at gmail.com
Wed Oct 12 06:32:53 CEST 2011


****** input tetrahedra for BZ-integration ******
   6   3  12
  0.000000  0.000000  0.000000
  0.750000  0.750000  0.000000
  1.000000  0.500000  0.000000
  0.500000  0.500000  0.500000
  1.000000  0.000000  0.000000
  1.000000  0.250000  0.250000
****** input tetrahedra for BZ-integration ******
********************** generate_tetra *********************
  NT0=           3  NTETMX=        1728
    0.0000   0.7500   1.0000   0.5000
    0.0000   0.7500   0.5000   0.5000
    0.0000   0.0000   0.0000   0.5000
    1.0000   1.0000   1.0000   1.0000
  volume of tetrahedron =  0.03125
    0.0000   1.0000   1.0000   1.0000
    0.0000   0.5000   0.0000   0.2500
    0.0000   0.0000   0.0000   0.2500
    1.0000   1.0000   1.0000   1.0000
  volume of tetrahedron =  0.02083
    0.0000   1.0000   0.5000   1.0000
    0.0000   0.5000   0.5000   0.2500
    0.0000   0.0000   0.5000   0.2500
    1.0000   1.0000   1.0000   1.0000
  volume of tetrahedron =  0.03125
  total volume of BZ is =   0.0833  omg48=  24.0000
****************** end of generate_tetra ******************
 Recalculating omega(q) from C(R)
Cannot match namelist object name alas444
STOP 2
head: cannot open `frequency' for reading: No such file or directory
head: cannot open `frequency' for reading: No such file or directory
(standard_in) 1: syntax error
At line 27 of file Partial_phonon_DOS.f90 (unit = 5, file = 'stdin')
Fortran runtime error: Bad integer for item 1 in list input
./run_Phonon_DOS.sh: line 204: frequency: No such file or directory
At line 6 of file atom_info.f90 (unit = 5, file = 'stdin')
Fortran runtime error: Bad integer for item 1 in list input
At line 58 of file Atom_projected_properties.f90 (unit = 9, file =
'projected.DOS')
Fortran runtime error: End of file
At line 66 of file Mean_square_displacement.f90 (unit = 5, file = 'stdin')
Fortran runtime error: End of file
mv: cannot stat `Displacements': No such file or directory
At line 6 of file atom_info.f90 (unit = 5, file = 'stdin')
Fortran runtime error: Bad integer for item 1 in list input
At line 58 of file Atom_projected_properties.f90 (unit = 9, file =
'projected.DOS')
Fortran runtime error: End of file
At line 66 of file Mean_square_displacement.f90 (unit = 5, file = 'stdin')
Fortran runtime error: End of file
mv: cannot stat `Displacements': No such file or directory
At line 75 of file Debye.f90 (unit = 10, file = 'PHDOS.out')
Fortran runtime error: End of file
At line 92 of file F_QHA.f90 (unit = 1, file = 'PHDOS.out')
Fortran runtime error: End of file
Phonon DOS and Quasiharmonic calculations have finished.
Now you can analyse these data using Gnuplot or xmgrace
Enjoy!
bds at Planck:~/bhabya/espresso-4.3/QHA/Examples/AlAs$





i want to compile the QHA code the error looks like what should i do
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