[CPMD-list] compilation qmmm on linux cluster

[Axel Kohlmeyer]

On Sun, 19 Jun 2005, Attilio wrote:


dear attilio,

[...]

AV> The compilation proceed until the Gromos section, when I get this error:
AV> 
AV> ................
AV> ................
AV> .o Gromos/mm_force.o Gromos/mm_setup.o Gromos/mm_setup_dr.o 
AV> Gromos/nbpml.o Gromos/nonbml.o Gromos/posio.o Gromos/random.o 
AV> Gromos/rdmd.o Gromos/rdtopo.o Gromos/schifezza.o Gromos/schifezza1.o 
AV> Gromos/shake.o Gromos/string.o Gromos/traco.o Gromos/wrtopo.o 
AV> Gromos/allocate_gromos.o
AV> Gromos/latsum.o: In function `c06fjf_':
AV> Gromos/latsum.o(.text+0x5333): undefined reference to `p01abf_'
AV> Gromos/latsum.o: In function `c06fff_':
AV> Gromos/latsum.o(.text+0x54ab): undefined reference to `p01abf_'
AV> Gromos/latsum.o: In function `c06ffz_':
AV> Gromos/latsum.o(.text+0x5787): undefined reference to `c06fcf_'
AV> make: *** [cpmd.x] Error 1
AV> 
AV> Does anyone had the same problem, or much better, know the solution?
AV> Thanks in advance,
AV> Attilio

yep, been there _and_ got the t-shirt.

try to apply the attached (trivial) patch and 
do a 'make reconfig ; make'

best regards,
	axel.

AV> 
AV> --------------------------------------
AV> Attilio Vittorio Vargiu
AV> PhD Student at SISSA/ISAS
AV> via Beirut 4
AV> I-34014 Trieste, Italy
AV> tel +390403787335   fax +390403787528
AV> 
AV> _______________________________________________
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AV> 
AV> 

-- 

=======================================================================
Dr. Axel Kohlmeyer   e-mail: axel.kohlmeyer at theochem.ruhr-uni-bochum.de
Lehrstuhl fuer Theoretische Chemie          Phone: ++49 (0)234/32-26673
Ruhr-Universitaet Bochum - NC 03/53         Fax:   ++49 (0)234/32-14045
D-44780 Bochum  http://www.theochem.ruhr-uni-bochum.de/~axel.kohlmeyer/
=======================================================================
If you make something idiot-proof, the universe creates a better idiot.
-------------- next part --------------
--- QMMM_OBJECTS	Wed Aug 14 17:52:49 2002
+++ QMMM_OBJECTS	Wed Jun 15 10:33:17 2005
@@ -1,4 +1,5 @@
 OBJECTS_GROMOS = Gromos/blockio.o  \
+                 Gromos/c06xxx.o \
                  Gromos/cobond.o  \
                  Gromos/conat.o  \
                  Gromos/fileio.o  \