[Wien] Segmentation fault: kgen kgen.def failed continues...

[shamik chakrabarti]

Dear Sir,

           I have done V-optimization and c/a optimization of Li doped SnS2
prior to force minimization and both the calculation ran fine. However,
with the structure with optimize lattice parameters when fed for force
minimization, the error occurred during x kgen.

Surprisingly if I copy some structure from earlier simulation regarding V
or c/a optimization in the same directory, the simulation fails to run. I
have deleted the directory and ran everything fresh, but still the error
occurs. The optimize lattice parameter for Li doped SnS2 was come as ;
a=b=3.7918 A & c= 6.72964 A

Looking forward to your suggestions.

with regards,


-- 
Dr. Shamik Chakrabarti
Research Fellow
Department of Physics
Indian Institute of Technology Patna
Bihta-801103
Patna
Bihar, India
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