DFT+U calculation error
Rizwan Nabi
rizwan... at gmail.com
Sun May 29 10:42:57 UTC 2016
Hi cp2k users i got following error while doing DFT + U calculations in
cp2k-4.0
*** 15:51:32 ERRORL2 in qs_environment:qs_init_subsys processor 0 :: ***
*** err=-300 condition FAILED at line 957 ***
*************************************************************************
===== Routine Calling Stack =====
3 qs_init_subsys
2 quickstep_create_force_env
1 CP2K
CP2K| condition FAILED at line 957
CP2K| Abnormal program termination, stopped by process number 0
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