FCI frequencies

[luis at klingon.uab.es]

Dear all,
I am doinf a FCI calculation on the H3 system in an alpha dec osf4.0
workstation.
The optimization runs OK, but the frequency calculation
crashes at the first FCI step:
---------------------------------------------------------------------------------
 Run Hamiltonian processor DAVIDSON
 Symmetry:                   5
 Trial vector:                  0.00
 Result vector:                 0.00
 Maximum iterations:           35
 Convergence threshold:         0.0000100
 RHS vector:                    0.00
 Hamiltonian shift:             0.0000000
 Output threshold:              0.0500000
 Options:                        0
 Number of roots:             1
0Hamiltonian diagonaliser entered at time   5546.38

 ERROR EXIT
--------------------------------------------------------------------------------

Does anyone have a suggestion?
The input file is:

***,h3lin_fci
memory,100,M
file,1,h3lin_fci.ints
file,2,h3lin_fci.wfu
basis=AVTZ
geometry={;
angstrom
H1;H2,H1,r;H3,H2,r,H1,180.,
}
r=0.8

int
thr,40,40
pri,0

hf
wf,3,5,1
accu,15
orbprint,2
pop
fci
wf,3,5,1
optg,gaussian
frequencies


Luis Rodriguez


_____________________________________________

Luis Rodriguez Santiago
Unitat de Quimica Fisica
Departament de Quimica
Edifici C
Universitat Autonoma de Barcelona
08193 Bellaterra, Spain

Phone: +34 93 5812173
Fax: +34 93 5812920
E-mail: luis at klingon.uab.es
_____________________________________________


_____________________________________________________

Luis Rodriguez Santiago
Laboratoire Analyse et Environnement, CNRS UMR 8587
Université d'Evry-Val d'Essonne
Boulevard François Mitterrand 91025 Evry Cedex

Tel: 33 1 69 47 76 45
Fax: 33 1 69 47 76 55
E-mail: Luis.Rodriguez at chimie.univ-evry.fr
_____________________________________________________