[Wien] re : Wien2k_04 update
George Amolo
amolo at schonlan.src.wits.ac.za
Sat Jun 19 20:46:33 CEST 2004
Dear laurence Marks, Wien2k users
I have downloaded the complete Wien2k_04 version and installed it in a
separate location from Wien2k_03. After having successfully compiled it I
am having trouble running even the TiO2 I performed with the earlier
version. Is there something I have forgotten to do? Do I need to remove
the earlier version? Or should I individually download the bits I need and
update Wien2k_03?
My particular interest in the New Mini port gives an error of the form :
Calculating tio2 in /mnt/home/amolo/tio2
on indlovu.src.wits.ac.za
> start (Sat Jun 19 20:16:53 SAST 2004) with lapw0 (50/20 to go)
> lapw0 (20:16:53) 8.520u 0.160s 0:09.32 93.1% 0+0k 0+0io 210pf+0w
:FORCE convergence: 0 0.1 0 XCO 538.0515000000000000 ZCO
> lapw1 (20:17:03) 42.190u 0.710s 0:44.76 95.8% 0+0k 0+0io 246pf+0w
> lapw2 (20:17:48) Segmentation fault
>0.410u 0.010s 0:01.01 41.5% 0+0k 0+0io 165pf+0w
> stop error
Any suggestions? thank you in advance
george
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