[molpro-user] Crash after 200 iterations
Yann Tambouret
yannpaul at bu.edu
Fri Feb 18 01:17:48 GMT 2005
Dear molpro user group,
I've seen this error statement several times, and I have not been able
to understand why it is occuring:
FILE 1 RECORD 1500 OFFSET= 0. NOT FOUND
Records on file 1
IREC NAME TYPE OFFSET LENGTH IMPLEMENTATION EXT
PREV PARENT MPP_STATE
1 500 VAR 4096. 57202. df 0
0 0 0
2 600 BASINP 61298. 72. df 0
0 0 0
3 700 GEOM 61370. 20914. df 0
0 0 0
4 960 ABASIS 82284. 2. df 0
0 0 0
5 900 SYMINP 82286. 470. df 0
0 0 0
6 950 ZMAT 82756. 89. df 0
0 0 0
7 970 AOBASIS 82845. 528. df 0
0 0 0
8 1000 BASIS 83373. 2343. df 0
0 0 0
9 1100 S 85716. 1098. df 0
0 0 0
10 1400 T 86814. 1098. df 0
0 0 0
11 1410 V 87912. 1098. df 0
0 0 0
12 1200 H0 89010. 1098. df 0
0 0 0
13 1210 H01 90108. 1098. df 0
0 0 0
14 1080 AOSYM 91206. 116. df 0
0 0 0
15 1600 SMH 91322. 1096. df 0
0 0 0
16 129 P2S 92418. 528. df 0
0 0 0
17 1650 MOLCAS 92946. 283697. df 0
0 0 0
18 1300 ERIS 376643. 1269762. df 0
0 0 0
19 1700 OPER 1646405. 3328. df 0
0 0 0
20 1380 JKOP 1649733. 152013. df 0
0 0 0
? Error
? Record not found
? The problem occurs in readm
ERROR EXIT
CURRENT STACK: CIPRO MAIN
It always happens after the 200th iteration of a CI run. I have set
MAXITER,500,500.
If I don't get a reply, I'll assume no one has seen this, and I'll
report it as a bug.
Thanks for your time.
Yann Tambouret
BU Chemistry
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