Dear all Quantum Espresso users and developers,
I want to do a geometry optimization on Sodalite. My problem is that apparently after 100 iterations it does not converge and the run stops. I attach my both input file and output file. Any help would be unconditionally appreciated. Best, Amir M. Mofrad University of Missouri
SOD.geo.relax.in
Description: SOD.geo.relax.in
SOD.geo.relax.out
Description: SOD.geo.relax.out
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