atomes 1.1.14
atomes: an atomic scale modeling tool box
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Write XYZ atomic coordinates. More...
Go to the source code of this file.
Functions/Subroutines | |
integer(kind=c_int) function | read_xyz (xyz_f, lxyz, is_npt) |
integer function | test_length (unitfile, natl) |
subroutine | send_label (sp_id, sp_ln, spec_label) |
integer(kind=c_int) function | write_xyz (xyz_f, lxyz, fxyz, txyz) |
Write XYZ atomic coordinates.
Definition in file xyz.F90.
integer (kind=c_int) function read_xyz | ( | character (kind=c_char), dimension(*), intent(in) | xyz_f, |
integer (kind=c_int), intent(in) | lxyz, | ||
integer (kind=c_int), intent(in) | is_npt ) |
subroutine send_label | ( | integer (kind=c_int), intent(in) | sp_id, |
integer (kind=c_int), intent(in) | sp_ln, | ||
character (kind=c_char), dimension(sp_ln), intent(in) | spec_label ) |
integer function test_length | ( | integer, intent(in) | unitfile, |
integer, intent(in) | natl ) |