How we can calculate the Formation energy of a single perovskite material such as MgFeH3 in KJ/mol.H2? I have calculated in eV/atom. I need KJ/mol.H2?

01 October 2023 1 8K Report

How we can calculate the Formation energy of a single perovskite material such as MgFeH3 in KJ/mol.H2?

I have calculated in eV/atom.

Please guide me on how I can convert -18.1 eV/atom to KJ/mol.H2

#Kaushik thank you for your time and consideration but your answer is totally wrong. The correct answer will be near about - 70 KJ/mol.H2

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