[QE-users] ΔS calculation in quantum espresso
Impact Group
impactgroup at proton.me
Sun Feb 12 17:30:12 CET 2023
Dear all,
For the caloric materials, ΔS_M , defined as ∫(∂M/∂T)dH is an important value.
Can we calculate ΔS_M in QE?
Kindly let me know.
Regards,
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