Itanium2/ DSYMV and DGEMV problem
Ludger Palm
Ludger.Palm at lrz-muenchen.de
Wed Oct 8 14:41:31 BST 2003
Dear colleagues,
I also hit the problem related to DSYMV and DGEMV:
I could compile and link MOLPRO 2002.6 on our IA64 and the line
LIBS="-lz -Vaxlib -lcrypt -L/usr/lib/gcc-lib/ia64-redhat-linux/2.96
-lg2c"
is in CONFIG.
Nevertheless, when executing molpro, I get the output:
-----------------------------------
***,h2o, lptest
memory,20,m
r=1.85,theta=104
geometry={
O;
H1,O,r;
H2,O,r,H1,theta
}
!gdirect
basis=sto-3g
hf
...
Installed patches: cidps_orthp configure_xeon dft_orbital_hi
enest_dummy fujitsu_conf fujitsu-ssl2
ga_conflict2 ia64root_check merge_orbdom mkl60
modelopt molden_orbital_normalization
mpputil mxm_fujitsu nec_parse opteron2
patcher_printf posinp
readop_multipole_np sun_forte8
...
NUCLEAR REPULSION ENERGY 8.99162654
? Error
? failure in dsyev
? The problem occurs in diag2
ERROR EXIT
CURRENT STACK: MAIN
------------------------------------
Does anybody know, how to solve this problem?
Matt Hodges schrieb:
>
> >>>>> Jacek Klos writes:
>
> > I don't have such a library libg2c.so in /usr/lib. What I have
> > found only is /usr/lib/gcc-lib/ia64-redhat-linux/2.96/libg2c.a
>
> I'm not a RedHat user, so I don't know if this is provided by a
> package that you don't have installed.
>
> > I would have to add in LIBS
> > -L/usr/lib/gcc-lib/ia64-redhat-linux/2.96 -lg2c ?
>
> I think this should be OK.
>
> Matt
--
Yours sincerely / Mit freundlichen Gruessen
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