A small energy term could matter in materials calculations
Samuel Poncé and Xavier Gonze clarify how electron–phonon effects enter calculated total energies, reporting leading corrections of 3.8 meV per atom in diamond and 9.7 meV per atom in GaN.
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Subscribe via RSSSamuel Poncé and Xavier Gonze clarify how electron–phonon effects enter calculated total energies, reporting leading corrections of 3.8 meV per atom in diamond and 9.7 meV per atom in GaN.
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