[molpro-user] Molpro 2006.1 compilation fails on Mac OS X PPC

[Nick Wilson]

Dear Jacek,

If you remove the -qfixed=80 option from CONFIG then you should be OK

Best wishes,
Nick

Jacek Klos wrote:
> Dear Molpro Users
> I am trying to compile Molpro 2006.1 on Apple X-Server PowerPC G5
> machine with Mac OS X system using xlf compiler. The first error I got 
> was that .f90 suffix was not recognized.
> When I corrected F90 entry in CONFIG file to:
> F90="/opt/ibmcmp/xlf/8.1/bin/xlf90 -NA16384 -NQ20000  -qzerosize 
> -qsuffix=f=f90 -qextname -qmaxmem=-1 -qarch=auto -I. 
> -I/apps/mha/molpro2006.1/src
> 
> (changed xlf to xlf90 and added -qsuffix=f=f90 option and removed 
> -qfixed=80 from original F90 line)
> 
> the *.f90 files compiled, but later I received the following error:
> 
> Rebuilding src/Molcas/depend
> molpro.f: preprocessing ... compiling ... failed:
> /opt/ibmcmp/xlf/8.1/bin/xlf -NA16384 -NQ20000 -qfixed=80 -qzerosize 
> -qextname -qmaxmem=-1 -qarch=auto -I. -I/apps/mha/molpro2006.1/src -c 
> -I./global -O2 molpro.f
> ** molpro   === End of Compilation 1 ===
> "./common/tapes", line 19.72: 1515-022 (E) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/tapes", line 19.73: 1515-019 (S) Syntax is incorrect.
> "./common/tapes", line 19.73: 1515-018 (S) Incorrect character found in 
> source at line 1-19 in column 73.  Hexadecimal value of character is 26.
> "./common/cmpp", line 17.64: 1515-022 (E) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/cmpp", line 17.73: 1515-018 (S) Incorrect character found in 
> source at line 3-17 in column 73.  Hexadecimal value of character is 26.
> "./common/cmpp", line 18.22: 1515-022 (S) Syntax Error: Extra token " 
> nprocx " was found. The token is ignored.
> "./common/cmpp", line 18.28: 1515-022 (S) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/cmpp", line 18.29: 1515-022 (S) Syntax Error: Extra token " 
> iprocx " was found. The token is ignored.
> "./common/cmpp", line 18.35: 1515-022 (S) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/cmpp", line 18.36: 1515-022 (S) Syntax Error: Extra token " 
> proclist " was found. The token is ignored.
> "./common/cmpp", line 18.44: 1515-022 (S) Syntax Error: Extra token " ( 
> " was found. The token is ignored.
> "./common/cmpp", line 18.45: 1515-022 (S) Syntax Error: Extra token " 
> maxproc " was found. The token is ignored.
> "./common/cmpp", line 18.52: 1515-022 (S) Syntax Error: Extra token " ) 
> " was found. The token is ignored.
> ** init_molpro   === End of Compilation 2 ===
> "./common/cmpp", line 17.64: 1515-022 (E) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/cmpp", line 17.73: 1515-018 (S) Incorrect character found in 
> source at line 5-17 in column 73.  Hexadecimal value of character is 26.
> "./common/cmpp", line 18.22: 1515-022 (S) Syntax Error: Extra token " 
> nprocx " was found. The token is ignored.
> "./common/cmpp", line 18.28: 1515-022 (S) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/cmpp", line 18.35: 1515-022 (S) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/cmpp", line 18.36: 1515-022 (S) Syntax Error: Extra token " 
> proclist " was found. The token is ignored.
> "./common/cmpp", line 18.44: 1515-022 (S) Syntax Error: Extra token " ( 
> " was found. The token is ignored.
> "./common/cmpp", line 18.45: 1515-022 (S) Syntax Error: Extra token " 
> maxproc " was found. The token is ignored.
> "./common/cmpp", line 18.52: 1515-022 (S) Syntax Error: Extra token " ) 
> " was found. The token is ignored.
> ** run_molpro   === End of Compilation 3 ===
> "./common/tapes", line 19.72: 1515-022 (E) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/tapes", line 19.73: 1515-019 (S) Syntax is incorrect.
> "./common/tapes", line 19.73: 1515-018 (S) Incorrect character found in 
> source at line 6-19 in column 73.  Hexadecimal value of character is 26.
> "./common/cmpp", line 17.64: 1515-022 (E) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/cmpp", line 17.73: 1515-018 (S) Incorrect character found in 
> source at line 8-17 in column 73.  Hexadecimal value of character is 26.
> "./common/cmpp", line 18.22: 1515-022 (S) Syntax Error: Extra token " 
> nprocx " was found. The token is ignored.
> "./common/cmpp", line 18.28: 1515-022 (S) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/cmpp", line 18.29: 1515-022 (S) Syntax Error: Extra token " 
> iprocx " was found. The token is ignored.
> "./common/cmpp", line 18.35: 1515-022 (S) Syntax Error: Extra token " , 
> " was found. The token is ignored.
> "./common/cmpp", line 18.36: 1515-022 (S) Syntax Error: Extra token " 
> proclist " was found. The token is ignored.
> "./common/cmpp", line 18.44: 1515-022 (S) Syntax Error: Extra token " ( 
> " was found. The token is ignored.
> "./common/cmpp", line 18.45: 1515-022 (S) Syntax Error: Extra token " 
> maxproc " was found. The token is ignored.
> "./common/cmpp", line 18.52: 1515-022 (S) Syntax Error: Extra token " ) 
> " was found. The token is ignored.
> ** term_molpro   === End of Compilation 4 ===
> 1501-511  Compilation failed for file molpro.f.
> 
> Looks like xlf compiler doesn't like those continuation lines in 
> ./common/tapes and similar files in common.
> 
> What can be done to resolve this problem?
> Thank you
> Best regards
> Jacek A. Klos
> ---------------------------------
> Quantum Chemistry Laboratory     |
> Department of Chemistry          |
> University of Warsaw             |
> Pasteura 1 Street                |
> 02-093 Warsaw                    |
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