[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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