[molpro-user] Parallel Molpro 2002.6 on ALTIX 350

[Jacek Klos]

Hi Ross,
I tried this gmake options as you wrote and I get the following error
during gmake of GA:
IPO Error: unresolved : _fastbcopy
         Referenced in libarmci.a(armci.o)
         Referenced in libarmci.a(message.o)
         Referenced in libarmci.a(mutex.o)
         Referenced in libarmci.a(strided.o)
         Referenced in libarmci.a(vector.o)
         Referenced in libarmci.a(rmw.o)
         Referenced in libarmci.a(memlock.o)
         Referenced in libarmci.a(request.o)
../../lib/LINUX64/libarmci.a(strided.o)(.text+0x24b2): In function 
`armci_copy_2D':
: undefined reference to `_fastbcopy'
../../lib/LINUX64/libarmci.a(strided.o)(.text+0x2532): In function 
`armci_copy_2D':
: undefined reference to `_fastbcopy'
../../lib/LINUX64/libarmci.a(strided.o)(.text+0x2572): In function 
`armci_copy_2D':
: undefined reference to `_fastbcopy'
../../lib/LINUX64/libarmci.a(strided.o)(.text+0x2632): In function 
`armci_copy_2D':
: undefined reference to `_fastbcopy'
../../lib/LINUX64/libarmci.a(strided.o)(.text+0x2692): In function 
`armci_copy_2D':
: undefined reference to `_fastbcopy'
../../lib/LINUX64/libarmci.a(strided.o)(.text+0x2712): more undefined 
references to `_fastbcopy' follow
gmake[2]: *** [test.x] Error 1
rm util.o ffflush.o test.o
gmake[2]: Leaving directory `/opt/GlobalArray3.3.3/g/global/testing'
gmake[1]: *** [test.x] Error 1
gmake[1]: Leaving directory `/opt/GlobalArray3.3.3/g/global'
gmake: *** [test] Error 2

Did you run into this error?
Thank you
Jacek

Ross wrote------
Hi Jacek,

If you want to use the TCGMSG-based version of the GA, you will need to
build with

make TARGET=LINUX64 CC=icc FC=ifort

Cheers,
Ross

-----Original Message-----
From: owner-molpro-user at molpro1.chem.cf.ac.uk [mailto:owner-molpro-
user at molpro1.chem.cf.ac.uk] On Behalf Of Jacek Klos
Sent: 14 September 2005 17:28
To: molpro-user at molpro.net
Subject: [molpro-user] Parallel Molpro 2002.6 on ALTIX 350

Dear Molpro users,
I am trying to install parallel version of molpro 2002.6
on SGI ALTIX 350 Itanium2 system with NUMAlink interconnect.
I use ifort 9 and icc 9 Intel compiler. I succesfully compiled
and linked serial version of Molpro, but I run into problems
with parallel version.
I am seeking advise on how  to properly compile Global Arrays
and link it with Molpro installation. If I compile GA
using TARGET=LINUX it compiles, but molpro linker fails
with a lot of unresolved symbols, for example:
IPO Error: unresolved : pbeginf_
          Referenced in libmolpro.a(mpputil.o)
IPO Error: unresolved : mitob_
          Referenced in libmolpro.a(mpputil.o)
          Referenced in libmolpro.a(globalop.o)
IPO Error: unresolved : pend_
          Referenced in libmolpro.a(mpputil.o)
IPO Error: unresolved : nodeid_
          Referenced in libmolpro.a(mpputil.o)
IPO Error: unresolved : nnodes_
          Referenced in libmolpro.a(mpputil.o)
IPO Error: unresolved : mdtob_
          Referenced in libmolpro.a(mpputil.o)
          Referenced in libmolpro.a(globalop.o)
          Referenced in libmolpro.a(getbs.o)

/opt/GlobalArray3.3.3/g/lib/LINUX/libarmci.a(fence.o)(.text+0xaa1): In
function `ARMCI_Barrier':
: undefined reference to `SYNCH_'
/opt/GlobalArray3.3.3/g/lib/LINUX/libarmci.a(message.o)(.text+0x15a2):
In
function `armci_msg_barrier':
_sbuf/message.c:377: undefined reference to `SYNCH_'
/opt/GlobalArray3.3.3/g/lib/LINUX/libarmci.a(message.o)(.text+0x15f2):
In
function `armci_msg_me':
_sbuf/message.c:391: undefined reference to `NODEID_'
/opt/GlobalArray3.3.3/g/lib/LINUX/libarmci.a(message.o)(.text+0x1652):
In
function `armci_msg_nproc':
_sbuf/message.c:405: undefined reference to `NNODES_'
/opt/GlobalArray3.3.3/g/lib/LINUX/libarmci.a(message.o)(.text+0x16b2):
In
function `armci_timer':
_sbuf/message.c:419: undefined reference to `tcgtime_'
/opt/GlobalArray3.3.3/g/lib/LINUX/libarmci.a(message.o)(.text+0x1752):
In
function `armci_msg_abort':

and so on.
I think my GA installation is not full and I will be glad to hear from
experts in this matter.
Thank you in advance
Jacek

Jacek A. Klos
---------------------------------
Quantum Chemistry Laboratory     |
Department of Chemistry          |
University of Warsaw             |
Pasteura 1 Street                |
02-093 Warsaw                    |
Poland                           |
(+4822)8220211 ext. 213          |
e-mail: jakl at tiger.chem.uw.edu.pl|
---------------------------------


Jacek A. Klos
---------------------------------
Quantum Chemistry Laboratory     |
Department of Chemistry          |
University of Warsaw             |
Pasteura 1 Street                |
02-093 Warsaw                    |
Poland                           |
(+4822)8220211 ext. 213          |
e-mail: jakl at tiger.chem.uw.edu.pl|
---------------------------------