[CP2K-user] segmentation fault for Hartree fock calculation
DIPAK PRASAD
prasadd... at gmail.com
Wed Nov 28 16:55:11 UTC 2018
I am trying to perform b3lyp calculation for water but i am getting
following error: Program received signal SIGSEGV: Segmentation fault -
invalid memory reference. This error is actually for HF section in XC. I
successfully run the script with pbe where HF section was not required. I
also tried with examples with HF section but got the same error.
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