most citedElectron-phonon interaction contribution to the total energy of group IV semiconductor polymorphs: evaluation and implications

6 citations · 6 across the 1 of their papers we have counts for

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1 paper

cond-mat.mtrl-sci2022★ 6 cited

Electron-phonon interaction contribution to the total energy of group IV semiconductor polymorphs: evaluation and implications

R. Arjun Varma, Shilpa Paul, Anup Itale +8

In density functional theory (DFT) based total energy studies, the van der Waals (vdW) and zero-point vibrational energy (ZPVE) correction terms are included to obtain energy diffe…