[QE-users] Convergence Issue While running elastic constant using thermo_pw

Narayanan Namboodiri P narayanan.n at srmap.edu.in
Mon Mar 9 05:12:33 CET 2026


Dear Users,

            I was trying to run the elastic constant calculation for my
systems in Quantum Espresso in qe_7.0 using thermo_pw (version_1.7.0). I
used the same optimised structure in prefix_scf.in, but the calculation is
not converging and moving further. Can anybody help me to resolve
this issue?

Thanking you in advance

regards
Narayanan
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