model with TIP4 water minimization getting crashed every time

From: Faisal, H M Nasrullah (hmnasrullah.faisal_at_ndsu.edu)
Date: Tue Oct 27 2020 - 10:04:49 CDT

Hi all,

I am trying to minimize a clay model with TIP4 water. But every time my simulation is getting crashed.
In the log file I am getting this error message

LINE MINIMIZER REDUCING GRADIENT FROM nan TO nan
[0] Stack Traceback:
[4] Stack Traceback:
  [4:0] [0xf89027]
  [4:1] [0xb031c6]
  [0:0] [0xf89027]
  [0:1] [0xb031c6]
  [0:2] [0x10853ce]
  [0:3] [0x11a8f67]
  [0:4] [0x1320ba5]
  [0:5] [0x101d769]
  [0:6] TclInvokeStringCommand+0x88 [0x1371e88]
  [0:7] [0x1374aa7]
  [0:8] [0x1375ec2]
  [0:9] [0x13766e6]
  [0:10] [0x13d8891]
  [0:11] [0x13d8a4e]
  [0:12] [0x1019da0]
  [0:13] [0x50fc71]
  [0:14] __libc_start_main+0xf5 [0x2aaaab930545]
  [0:15] _ZNSt8ios_base4InitD1Ev+0x49 [0x40e4e9]

At the same time, In another generated file I am getting another error message:
------------- Processor 0 Exiting: Caught Signal ------------
Signal: segmentation violation
Suggestion: Try running with '++debug', or linking with '-memory paranoid' (memory paranoid requires '+netpoll' at runtime).
------------- Processor 4 Exiting: Caught Signal ------------
Signal: segmentation violation
Suggestion: Try running with '++debug', or linking with '-memory paranoid' (memory paranoid requires '+netpoll' at runtime).
Fatal error on PE 0> segmentation violation

I have gone through the structure. There is no possibility of nuclear crashes as the same model is working TIP3 water. I have also checked the coordinates of TIP4 water very carefully. I am really stuck here. Could anybody give me some insight?
Thanks in advance.

Faisal

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