[Wien] Serial installation of WIENNCM package

[Bramhachari Khamari]

Dear all,
          I am not able  to install(serial installation) WIENNCM package in
my system. To compile the WIENNCM I have used the following OPTIONS file ,

current:FOPT:-FR -mp -w -I/opt/intel/mkl/include
current:FPOPT:-FR -mp -w -I/opt/intel/mkl/include
current:LDFLAGS:-L/opt/intel/mkl/lib/intel64
current:DPARALLEL:'-DParallel'
current:R_LIBS:-lmkl_lapack95_lp64 -lmkl_intel_lp64 -lmkl_intel_thread
-lmkl_core -openmp -lpthread -L/opt/intel/mkl/lib/intel64
current:RP_LIBS:-lmkl_scalapack_lp64 -lmkl_blacs_lp64 $(R_LIBS)
-L/opt/intel/mkl/lib/intel64

There was no compilation error in the directories except in SRC_dstart. I
got the following error message during compilation,

SRC_dstart/compile.msg:ifort: error #10236: File not found:  'cputim.o'
SRC_dstart/compile.msg:make: *** [dstart] Error 1.
Can any body suggest what went wrong .

Re: In some packages there were no this subroutine added, and I took it from
directories of WIEN2k. It is in many directories, search cputim*.

Best wishes
   Lyudmila Dobysheva

 According to suggestion given by Lyudmila Dobysheva, I took the 'cputim.o'
file from wien2k directory (SRC_dstart) and put into SRC_dstart of WIENNCM.
After recompiling I got the following message in compile.msg file

module.o: In function `param._':
module.f:(.text+0x0): multiple definition of `param._'
module.o:module.f:(.text+0x0): first defined here
module.o: In function `defs._':
module.f:(.text+0x10): multiple definition of `defs._'
module.o:module.f:(.text+0x10): first defined here
module.o: In function `reallocate._':
module.f:(.text+0x20): multiple definition of `reallocate._'
module.o:module.f:(.text+0x20): first defined here
module.o: In function `reallocate_mp_doreallocate_r8_d1_':
module.f:(.text+0x30): multiple definition of
`reallocate_mp_doreallocate_r8_d1_'
module.o:module.f:(.text+0x30): first defined here
module.o: In function `reallocate_mp_doreallocate_r8_d2_':
module.f:(.text+0x3f0): multiple definition of
`reallocate_mp_doreallocate_r8_d2_'
module.o:module.f:(.text+0x3f0): first defined here
module.o: In function `reallocate_mp_doreallocate_c16_d1_':
module.f:(.text+0xbe0): multiple definition of
`reallocate_mp_doreallocate_c16_d1_'
module.o:module.f:(.text+0xbe0): first defined here
module.o: In function `reallocate_mp_doreallocate_c16_d2_':
module.f:(.text+0xf50): multiple definition of
`reallocate_mp_doreallocate_c16_d2_'
module.o:module.f:(.text+0xf50): first defined here
module.o: In function `reallocate_mp_doreallocate_i4_d1_':
module.f:(.text+0x16b0): multiple definition of
`reallocate_mp_doreallocate_i4_d1_'
module.o:module.f:(.text+0x16b0): first defined here
module.o: In function `reallocate_mp_doreallocate_i4_d2_':
module.f:(.text+0x1a00): multiple definition of
`reallocate_mp_doreallocate_i4_d2_'
module.o:module.f:(.text+0x1a00): first defined here
module.o: In function `reallocate_mp_hugo_':
module.f:(.text+0x21d0): multiple definition of `reallocate_mp_hugo_'
module.o:module.f:(.text+0x21d0): first defined here
module.o: In function `struct._':
module.f:(.text+0x2220): multiple definition of `struct._'
module.o:module.f:(.text+0x2220): first defined here
module.o: In function `struct_mp_latgen_struct_':
module.f:(.text+0x2230): multiple definition of `struct_mp_latgen_struct_'
module.o:module.f:(.text+0x2230): first defined here
module.o: In function `struct_mp_invert_struct_':
module.f:(.text+0x3590): multiple definition of `struct_mp_invert_struct_'
module.o:module.f:(.text+0x3590): first defined here
module.o: In function `waves._':
module.f:(.text+0x3640): multiple definition of `waves._'
module.o:module.f:(.text+0x3640): first defined here
module.o: In function `four._':
module.f:(.text+0x3650): multiple definition of `four._'
module.o:module.f:(.text+0x3650): first defined here
module.o: In function `lmmod._':
module.f:(.text+0x3660): multiple definition of `lmmod._'
module.o:module.f:(.text+0x3660): first defined here
module.o: In function `rspmod._':
module.f:(.text+0x3670): multiple definition of `rspmod._'
module.o:module.f:(.text+0x3670): first defined here
module.o: In function `neiglistmod._':
module.f:(.text+0x3680): multiple definition of `neiglistmod._'
module.o:module.f:(.text+0x3680): first defined here
module.o: In function `neiglistmod_mp_end_neiglistmod_':
module.f:(.text+0x3690): multiple definition of
`neiglistmod_mp_end_neiglistmod_'
module.o:module.f:(.text+0x3690): first defined here
module.o:(.data+0xf60): multiple definition of `neiglistmod_mp_neighlist_'
module.o:(.data+0xf60): first defined here
module.o:(.data+0xf00): multiple definition of `neiglistmod_mp_neighpos_'
module.o:(.data+0xf00): first defined here
module.o: In function `neiglistmod_mp_init_neiglistmod_':
module.f:(.text+0x3730): multiple definition of
`neiglistmod_mp_init_neiglistmod_'
module.o:module.f:(.text+0x3730): first defined here
module.o: In function `rspmod_mp_init_rspmod_':
module.f:(.text+0x3880): multiple definition of `rspmod_mp_init_rspmod_'
module.o:module.f:(.text+0x3880): first defined here
module.o:(.data+0xea0): multiple definition of `rspmod_mp_rhoat_'
module.o:(.data+0xea0): first defined here
module.o:(.data+0xde0): multiple definition of `rspmod_mp_nptat_'
module.o:(.data+0xde0): first defined here
module.o:(.data+0xe40): multiple definition of `rspmod_mp_rat_'
module.o:(.data+0xe40): first defined here
module.o: In function `lmmod_mp_init_lmmod_':
module.f:(.text+0x3b70): multiple definition of `lmmod_mp_init_lmmod_'
module.o:module.f:(.text+0x3b70): first defined here
module.o:(.data+0xd60): multiple definition of `lmmod_mp_lm_'
module.o:(.data+0xd60): first defined here
module.o:(.data+0xd00): multiple definition of `lmmod_mp_lmmax_'
module.o:(.data+0xd00): first defined here
module.o: In function `four_mp_init_four_':
module.f:(.text+0x3ce0): multiple definition of `four_mp_init_four_'
module.o:module.f:(.text+0x3ce0): first defined here
module.o:(.data+0xca0): multiple definition of `four_mp_taup_'
module.o:(.data+0xca0): first defined here
module.o:(.data+0xbe0): multiple definition of `four_mp_stg_'
module.o:(.data+0xbe0): first defined here
module.o:(.data+0xc40): multiple definition of `four_mp_g_'
module.o:(.data+0xc40): first defined here
module.o: In function `struct_mp_init_struct_':
module.f:(.text+0x3e80): multiple definition of `struct_mp_init_struct_'
module.o:module.f:(.text+0x3e80): first defined here
module.o:(.data+0x800): multiple definition of `struct_mp_aname_'
module.o:(.data+0x800): first defined here
module.o:(.data+0x7a0): multiple definition of `struct_mp_mult_'
module.o:(.data+0x7a0): first defined here
module.o:(.data+0x740): multiple definition of `struct_mp_jrj_'
module.o:(.data+0x740): first defined here
module.o:(.data+0xac0): multiple definition of `struct_mp_r0_'
module.o:(.data+0xac0): first defined here
module.o:(.data+0xa60): multiple definition of `struct_mp_dx_'
module.o:(.data+0xa60): first defined here
module.o:(.data+0xa00): multiple definition of `struct_mp_rmt_'
module.o:(.data+0xa00): first defined here
module.o:(.data+0x9a0): multiple definition of `struct_mp_zz_'
module.o:(.data+0x9a0): first defined here
module.o:(.data+0x920): multiple definition of `struct_mp_rotloc_'
module.o:(.data+0x920): first defined here
module.o:(.data+0x6e0): multiple definition of `struct_mp_iatnr_'
module.o:(.data+0x6e0): first defined here
module.o:(.data+0x680): multiple definition of `struct_mp_isplit_'
module.o:(.data+0x680): first defined here
module.o:(.data+0x8c0): multiple definition of `struct_mp_v_'
module.o:(.data+0x8c0): first defined here
module.o:(.bss+0x20): multiple definition of `struct_mp_pos_'
module.o:(.bss+0x20): first defined here
module.o:(.data+0x600): multiple definition of `struct_mp_iz_'
module.o:(.data+0x600): first defined here
module.o:(.data+0x860): multiple definition of `struct_mp_tau_'
module.o:(.data+0x860): first defined here
module.o:(.data+0x5a0): multiple definition of `struct_mp_inum_'
module.o:(.data+0x5a0): first defined here
module.o:(.data+0x520): multiple definition of `struct_mp_rotij_'
module.o:(.data+0x520): first defined here
module.o:(.data+0x4c0): multiple definition of `struct_mp_tauij_'
module.o:(.data+0x4c0): first defined here
module.o:(.data+0x460): multiple definition of `struct_mp_tinv_'
module.o:(.data+0x460): first defined here
module.o:(.bss+0x0): multiple definition of `param_mp_nkpt_'
module.o:(.bss+0x0): first defined here
module.o:(.bss+0x8): multiple definition of `param_mp_nsym_'
module.o:(.bss+0x8): first defined here
module.o:(.bss+0x10): multiple definition of `param_mp_nume_'
module.o:(.bss+0x10): first defined here
module.o:(.bss+0x18): multiple definition of `param_mp_nmat_'
module.o:(.bss+0x18): first defined here
module.o:(.bss+0x80): multiple definition of `waves_mp_absk_'
module.o:(.bss+0x80): first defined here
module.o:(.bss+0xe0): multiple definition of `waves_mp_kzz_'
module.o:(.bss+0xe0): first defined here
module.o:(.data+0xb20): multiple definition of `waves_mp_tauk_'
module.o:(.data+0xb20): first defined here
module.o:(.data+0xb80): multiple definition of `waves_mp_inst_'
module.o:(.data+0xb80): first defined here
make: *** [dstart] Error 1
Waiting for more suggestion.

Regards:
Bramha
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