Fixed oversight in edits to example in Fortran doc page

This commit is contained in:
Karl Hammond 2022-09-30 19:51:56 -05:00
parent a323e09822
commit 6dea4d50d6
1 changed files with 5 additions and 5 deletions

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@ -193,17 +193,17 @@ Below is an example demonstrating some of the possible uses.
USE, INTRINSIC :: ISO_C_BINDING, ONLY : c_double, c_int64_t
USE, INTRINSIC :: ISO_FORTRAN_ENV, ONLY : OUTPUT_UNIT
TYPE(lammps) :: lmp
INTEGER(KIND=c_int64_t) :: natoms
INTEGER(KIND=c_int64_t), POINTER :: natoms
REAL(KIND=c_double), POINTER :: dt
INTEGER(KIND=c_int64_t), POINTER :: ntimestep
REAL(KIND=c_double) :: pe, ke
lmp = lammps()
CALL lmp%file('in.sysinit')
natoms = lmp%extract_setting('natoms')
WRITE(OUTPUT_UNIT,'(A,I8,A)') 'Running a simulation with', natoms, ' atoms'
WRITE(OUTPUT_UNIT,'(I8,A,I8,A,I3,A)') lmp%extract_setting('nlocal'), &
' local and', lmp%extract_setting('nghost'), ' ghost atom. ', &
natoms = lmp%extract_global('natoms')
WRITE(OUTPUT_UNIT,'(A,I0,A)') 'Running a simulation with', natoms, ' atoms'
WRITE(OUTPUT_UNIT,'(I0,A,I0,A,I0,A)') lmp%extract_setting('nlocal'), &
' local and', lmp%extract_setting('nghost'), ' ghost atoms. ', &
lmp%extract_setting('ntypes'), ' atom types'
CALL lmp%command('run 2 post no')