[molpro-user] Molpro Installation Problem

pcsm2 at iacs.res.in pcsm2 at iacs.res.in
Wed Feb 10 16:30:12 CET 2016


Dear Andy:

Thanks for your advice. The configure goes well now. 
The next problem occurs with "make" command.
It comes out with the following error:

**************************************************************************************************
$(FC) -c $(FFLAGS) $(F90FLAGS) -O3 fcimc_initialisation.F90
$(FC) -c $(FFLAGS) $(F90FLAGS) -O3 fcimc_output.F90
$(FC) -c $(FFLAGS) $(F90FLAGS) -O3 fcimc_iter_utilities.F90
/tmp/ifortaZkltL.i90: catastrophic error: **Internal compiler error:
segmentation violation signal raised** Please report this error along with
the circumstances in which it occurred in a Software Problem Report. 
Note: File and line given may not be explicit cause of this error.
compilation aborted for fcimc_iter_utilities.F90 (code 1)
make[3]: *** [fcimc_iter_utilities.o] Error 1

...

make[3]: Target `targets' not remade because of errors.
make[3]: Leaving directory `/export/home/iacs/Molpro/src/neci'
make[2]: *** [default] Error 2
make[2]: Leaving directory `/export/home/iacs/Molpro/src/neci'
make[1]: *** [neci] Error 2
make[1]: Leaving directory `/export/home/iacs/Molpro/src'
make: *** [src] Error 2

************************************************************************************************************

What can be done to make the installation success full. Please suggest.

with regards,
Saikat

----- Message from Andy May <ajmay81 at gmail.com> ---------
   Date: Tue, 9 Feb 2016 17:43:16 +0000
   From: Andy May <ajmay81 at gmail.com>
Subject: Re: [molpro-user] Molpro Installation Problem
     To: Saikat Mukherjee <pcsm2 at iacs.res.in>
     Cc:

> Saikat,[1]
>
>    It could be this system kernel is too old for the latest parse
> objects, please download the patch level 0 tarball, then simply copy
> from there the file src/parse/parse-Linux-x86_64-i8.o to replace the one
> you have at the moment.[1]
>     [1]
>    Best wishes,[1]
>     [1]
>    Andy[1]
>
>
>    On 9 February 2016 at 14:23, <[1]pcsm2 at iacs.res.in> wrote:
>
>> _Dear Andy,
>>
>> As you suggested I tried to compile a fortran program (fortran-test.f)
>> with the printed options as:
>>
>> "/export/intel/composerxe-2011.5.220/bin/intel64/ifort  -i8  -pc64
>>  -auto -vec-report0  -warn  nousage  -cxxlib  -O0  -lpthread 
>> fortran-test.f"
>>
>> It compiled fine giving no error!! The program ran as well. My
>> fortran-test.f contains:
>>
>> "       implicit none
>>         integer a
>>         a=1
>>         write(*,*)a
>>         end"
>>
>> Please suggest further.
>>
>> May be the problem comes due to the "parse" thing. I have no clue on
>> this.   
>>
>> with best regards, 
>> Saikat
>>
>> ----- Message from Andy May <_[1]_ajmay81 at gmail.com> ---------
>>    Date: Tue, 9 Feb 2016 12:18:21 +0000
>>    From: Andy May <ajmay81 at gmail.com>
>> Subject: Re: [molpro-user] Molpro Installation Problem
>>      To: pcsm2 at iacs.res.in
>>      Cc:_
>>
>>> _Saikat,[2]_
>>>         _ [2]_
>>>         _The error message gives you a suggestion, can you try
>>> compiling a trivial Fortran program using the printed options to see
>>> if it shows what the problem is?[2]_
>>>         _ [2]_
>>>         _Best wishes,[2]_
>>>         _ [2]_
>>>         _Andy[2]_
>>>
>>>
>>>         _On 6 February 2016 at 10:58, <[2]pcsm2 at iacs.res.in> wrote:_
>>>
>>>> __Dear Molpro User and Developers:
>>>>
>>>> We are running molpro 2010 parallely in 4 node of IBM Blade.  _[2]_
>>>>            __overview of present cluster architecture defined below: 
>>>>  _[2]_
>>>>            __total node: 4_[2]_
>>>>            __OS: Rocks cluster 64 bit_[2]_
>>>>            __network type: tcp/ip_[2]_
>>>>
>>>> __But while we are trying to install molpro 2012, it is showing
error:_
>>>> _/export/intel/composerxe-2011.5.220/bin/intel64/ifort  -i8  -pc64
>>>>  -auto
>>>> -vec-report0  -warn  nousage  -cxxlib  -O0  -lpthread_
>>>> _"unable to link the perse object using:
>>>>
>>>> /export/intel/composerxe-2011.5.220/bin/intel64/ifort  -i8  -pc64
>>>>  -auto
>>>> -vec-report0  -warn  nousage  -cxxlib  -O0  -lpthread
>>>>  /export/home/iacs/
>>>> Molpro/src/boost-install/lib/libboost_system.a
>>>>  /export/home/iacs/Molpro/
>>>> src/boost-install/lib/libboost_thread.a  -lrt
>>>>
>>>> Please check the compiler is working, flags are correct and all
>>>> libraries are present
>>>>
>>>> failed to determine PARSE
>>>>
>>>> Result so far of configure written to CONFIG.errout"
>>>>
>>>> Also the CONFIG.errout file has been attached below. 
>>>>  _[2]_
>>>> __Please help us to resolve this issue at your earliest.
>>>>
>>>> Thanks in advance
>>>> Saikat Mukherjee
>>>> Senior Research Fellow
>>>> Indian Association for the Cultivation
>>>> of Science, India_[2]_
>>>>
>>>> _________________________________________________
>>>> Molpro-user mailing list_[2]
>>>> _Molpro-user at molpro.net__
>>
>> __----- End message from Andy May <_[2]_ajmay81 at gmail.com> -----__
>>  

_----- End message from Andy May <_[1]_ajmay81 at gmail.com> -----_


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