[Pw_forum] 4.3 compile error.

[小S]

Hi, Vit.
I got the same problem like you.

You can open the file TDDFPT/src/lr_main.f90 and find the line 252. It should be written as:
IF ( lr_io_level > 0 .and. (mod(LR_iteration,restart_step)==0 .OR. LR_iteration==itermax .OR. LR_iteration==1) ) CALL lr_write_restart()
Then, you can add a '&' after '==1) )' and put 'CALL lr_write_restart()' to the next line.
Do not forget add enough space before 'CALL lr_write_restart()', otherwise it would become annotate instead of code.
The modified one could like:
IF ( lr_io_level > 0 .and. (mod(LR_iteration,restart_step)==0 .OR. LR_iteration==itermax .OR. LR_iteration==1) )  &
           CALL lr_write_restart()


At 2011-04-03 19:41:28，Vit <vitruss at gmail.com> wrote:

>Dear QE users!
>I'm having troubles compiling new release. I'm trying to use ACML where 
>apllicable, but I'm getting the same error even with distro (debian 6.0.1) 
>blas and lapack and internal fftw.
>Could you please help me resolving this issue?
>
>mpif90 -g -o turbo_lanczos.x \                                                                                   
>                lr_variables.o lr_charg_resp.o bcast_lr_input.o lr_readin.o 
>lr_alloc_init.o lr_calc_dens.o lr_dot.o lr_dealloc.o lr_ortho.o lr_read_wf.o 
>lr_normalise.o lr_lanczos.o lr_apply_liouvillian.o lr_main.o lr_dv_setup.o 
>lr_setup_dgc.o lr_solve_e.o lr_dvpsi_e.o lr_ch_psi_all.o lr_cgsolve_all.o 
>lr_h_psiq.o lr_sm1_psi.o stop_lr.o lr_read_d0psi.o lr_restart.o 
>lr_write_restart.o print_clock_lr.o sd0psi.o lr_set_boxes_density.o 
>lr_init_nfo.o  ../../PH/libph.a ../../PW/libpw.a ../../Modules/libqemod.a 
>../../flib/ptools.a ../../flib/flib.a ../../clib/clib.a 
>../../iotk/src/libiotk.a   -L/opt/acml4.4.0/gfortran64/lib -lacml -
>L/opt/acml4.4.0/gfortran64/lib -lacml -L/opt/acml4.4.0/gfortran64/lib -lacml                                                                                    
>lr_main.o: In function `lr_main':                                                                                
>/opt/qe/4.3/TDDFPT/src/lr_main.f90:252: undefined reference to `lr_wri_'                                         
>collect2: ld returned 1 exit status                                                                              
>make[2]: *** [turbo_lanczos.x] Error 1                                                                           
>make[2]: Leaving directory `/opt/qe/4.3/TDDFPT/src'                                                              
>make[2]: Entering directory `/opt/qe/4.3/TDDFPT/tools'                                                           
>test -n "" && ( cd ../.. ; make -w  || exit 1) || :                                                              
>mpif90 -O3 -g -x f95-cpp-input -D__GFORTRAN -D__STD_F95 -D__ACML -D__MPI -
>D__PARA -I../../include -I../../iotk/src -I../../Modules -I. -c 
>tddfpt_calculate_spectrum.f90                                                           
>mpif90 -g -o turbo_spectrum.x \                                                                                  
>        tddfpt_calculate_spectrum.o ../../Modules/libqemod.a ../../PW/libpw.a 
>../../flib/ptools.a ../../flib/flib.a ../../clib/clib.a 
>../../iotk/src/libiotk.a   -L/opt/acml4.4.0/gfortran64/lib -lacml -
>L/opt/acml4.4.0/gfortran64/lib -lacml -L/opt/acml4.4.0/gfortran64/lib -lacml                                                              
>( cd ../../bin ; ln -fs ../TDDFPT/tools/turbo_spectrum.x . )                                                     
>if [ -d ../bin ] ; then  ( cd ../bin ; ln -fs ../tools/turbo_spectrum.x . ); 
>fi                                  
>make[2]: Leaving directory `/opt/qe/4.3/TDDFPT/tools'                                                            
>make[1]: Leaving directory `/opt/qe/4.3/TDDFPT'       
>
>With best regards,
>Koroteev Victor.
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