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Message-ID: <47299252.1020607@chemie.hu-berlin.de>
Date: Thu, 01 Nov 2007 09:46:10 +0100
From: Thomas Dargel <td@chemie.hu-berlin.de>
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To:  nwchem-users@emsl.pnl.gov
Subject: [NWCHEM] Problems compiling NWChem50 and ARMCI_NETWORK=OPENIB
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Hi

  I am running into trouble with compiling NWChem-5.0 (x86-64, Intel Compiler 
9.1    Build 20061101) with InfiniBand support (ARMCI_NETWORK=OPENIB).

I also tried to merge GA-4-1-1B with the source from NWChem-5.0, without success.

These are last last lines from 'make':

ifort -c -i8 -align -w -g -vec_report3 -O2 -g  -I. 
-I/huge/td/NWChem-5.0/nwchem-5.0/src/include 
-I/huge/td/NWChem-5.0/nwchem-5.0/src/tools/include -DEXT_INT -DLINUX -DLINUX64 
-DIFCV8 -DIFCLINUX -DPARALLEL_DIAG -DNEED_LOC 
-DJOBTIMEPATH=\"/huge/td/NWChem-5.0/nwchem-5.0/bin/LINUX64\" 
-DBYTE_SHORT_PACKING    util_test.F
ifort -c -i8 -align -w -g -vec_report3 -O2 -g  -I. 
-I/huge/td/NWChem-5.0/nwchem-5.0/src/include 
-I/huge/td/NWChem-5.0/nwchem-5.0/src/tools/include -DEXT_INT -DLINUX -DLINUX64 
-DIFCV8 -DIFCLINUX -DPARALLEL_DIAG -DNEED_LOC 
-DJOBTIMEPATH=\"/huge/td/NWChem-5.0/nwchem-5.0/bin/LINUX64\" 
-DBYTE_SHORT_PACKING    util_ga_test.F
fortcom: Error: util_ga_test.F, line 1419: The CALL statement is invoking a 
function subprogram as a subroutine.   [GA_LOCATE_REGION]
       call ga_locate_region(g_a, 1, n, 1,n, map,np)
-----------^
compilation aborted for util_ga_test.F (code 1)
make[1]: *** 
[/huge/td/NWChem-5.0/nwchem-5.0/lib/LINUX64/libnwcutil.a(util_ga_test.o)] Error 1
make[1]: *** Waiting for unfinished jobs....
make: *** [libraries] Error 1

Does somebody can give me any guidance to gain a successful compilation of 
NWChem-5.0 with OPENIB support?

Thank you in advance,
best regards,

Thomas Dargel.