xtb icon indicating copy to clipboard operation
xtb copied to clipboard

xtb compialtion failure ...

Open husakm opened this issue 1 year ago • 1 comments

Discussed in https://github.com/grimme-lab/xtb/discussions/997

Originally posted by husakm March 20, 2024 I was trying to recompile xtb (by gfortran 10). All worked OK until aprox. 58% ready, thani have got following:

/cygdrive/m/My_Project/Fortran/XTB_cygwin/xtb-6.7.0/src/gfnff/gfnff_eg.f90:4039:
45:

 4039 |   real(wp), intent(in) :: rTrans( 3, product(2*ewaldCutD+1))
      |                                             1
Error: 'array' argument of 'product' intrinsic at (1) must be an array
/cygdrive/m/My_Project/Fortran/XTB_cygwin/xtb-6.7.0/src/gfnff/gfnff_eg.f90:4041:
44:

 4041 |   real(wp), intent(in) :: gTrans(3, product(2*ewaldCutR+1)-1)
      |                                            1
Error: 'array' argument of 'product' intrinsic at (1) must be an array
/cygdrive/m/My_Project/Fortran/XTB_cygwin/xtb-6.7.0/src/gfnff/gfnff_eg.f90:4041:
44:

 4041 |   real(wp), intent(in) :: gTrans(3, product(2*ewaldCutR+1)-1)
      |                                            1
Error: 'array' argument of 'product' intrinsic at (1) must be an array
/cygdrive/m/My_Project/Fortran/XTB_cygwin/xtb-6.7.0/src/gfnff/gfnff_eg.f90:4039:
45:

 4039 |   real(wp), intent(in) :: rTrans( 3, product(2*ewaldCutD+1))
      |                                             1
Error: 'array' argument of 'product' intrinsic at (1) must be an array
/cygdrive/m/My_Project/Fortran/XTB_cygwin/xtb-6.7.0/src/gfnff/gfnff_eg.f90:4039:
45:

 4039 |   real(wp), intent(in) :: rTrans( 3, product(2*ewaldCutD+1))
      |                                             1
Error: 'array' argument of 'product' intrinsic at (1) must be an array
/cygdrive/m/My_Project/Fortran/XTB_cygwin/xtb-6.7.0/src/gfnff/gfnff_eg.f90:1064:
68:

 1064 |            write(*,'(10x,"No H-atom found in this bond ",i0,1x,i0)'), ia
t,jat

Any idea what is wrong ?

Michal

husakm avatar Mar 20 '24 11:03 husakm

I get the same error with gfn-6.7.0 on linux

Linux samara 6.0.7-1207.native #1 SMP Thu Nov 3 09:15:51 PDT 2022 x86_64 GNU/Linux

GCC version 12.2.1

4039 |   real(wp), intent(in) :: rTrans( 3, product(2*ewaldCutD+1))
      |                                             1
Error: ‘array’ argument of ‘product’ intrinsic at (1) must be an array
/home/lsd/Downloads/xtb-6.7.0/src/gfnff/gfnff_eg.f90:4041:44:

 4041 |   real(wp), intent(in) :: gTrans(3, product(2*ewaldCutR+1)-1)
      |                                            1
Error: ‘array’ argument of ‘product’ intrinsic at (1) must be an array
/home/lsd/Downloads/xtb-6.7.0/src/gfnff/gfnff_eg.f90:4041:44:

 4041 |   real(wp), intent(in) :: gTrans(3, product(2*ewaldCutR+1)-1)
      |                                            1
Error: ‘array’ argument of ‘product’ intrinsic at (1) must be an array
/home/lsd/Downloads/xtb-6.7.0/src/gfnff/gfnff_eg.f90:4039:45:

 4039 |   real(wp), intent(in) :: rTrans( 3, product(2*ewaldCutD+1))
      |                                             1
Error: ‘array’ argument of ‘product’ intrinsic at (1) must be an array
/home/lsd/Downloads/xtb-6.7.0/src/gfnff/gfnff_eg.f90:4039:45:

 4039 |   real(wp), intent(in) :: rTrans( 3, product(2*ewaldCutD+1))
      |                                             1
Error: ‘array’ argument of ‘product’ intrinsic at (1) must be an array
/home/lsd/Downloads/xtb-6.7.0/src/gfnff/gfnff_eg.f90:2023:12:

butterflycollector avatar Apr 17 '24 09:04 butterflycollector