pw_grid_assign error
Yue
yueyan... at gmail.com
Mon Jul 30 22:12:44 UTC 2012
Hello,
I've encountered a problem with pw_grid_assign. The error message appears
immediately after molecules kind info:
MOLECULE KIND SET INFORMATION Total Number of bonds:
38484
Total Number of bends:
14053
Total Number of Urey-Bradley:
0
Total Number of torsions:
22124
Total Number of improper:
0
Total Number of opbends:
0
*************************************************************************
*** 15:05:21 ERRORL2 in pw_grids:pw_grid_assign processor 0 err=-300 ***
*** condition FAILED at line 1440 ***
*************************************************************************
===== Routine Calling Stack =====
8 pw_grid_assign
7 pw_grid_setup
6 ewald_pw_init
5 fist_init_subsys
4 fist_init
3 fist_create_force_env
2 qmmm_create_force_env_low
1 CP2K
CP2K| condition FAILED at line 1440
CP2K| Abnormal program termination, stopped by process number 0
CP2K| condition FAILED at line 1440
CP2K| Abnormal program termination, stopped by process number 4
CP2K| condition FAILED at line 1440
CP2K| Abnormal program termination, stopped by process number 1
CP2K| condition FAILED at line 1440
CP2K| Abnormal program termination, stopped by process number 3
My input is attached. Can anyone point out what's the problem here? Thank
you!
Best,
Yue
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