[Wien] reg:lapw2 error
Swetarekha Ram
swetarekharam at gmail.com
Sat Apr 14 15:48:19 CEST 2012
Dear Sir (Laurence Marks) and wien2k users,
Thank you for your reply.
I am using WIEN2k_11.1
This is MSR1a not PORT.
And after the 10th scf cycle I am getting the error.
My compound is having 3-types of atom and for one atom I have position
like this,
X=0.00000000 Y=0.35000000 Z=0.14700000
Can you give any suggestion to remove the error(forrtl: severe (174):
SIGSEGV, segmentation fault occurred)
And in lapw2.error file I am getting error
Error in LAPW2
Thanking You.
--
Swetarekha Ram,
Research Scholar,
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