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Phonon-related properties to be extracted #17

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blokhin opened this issue Aug 20, 2020 · 0 comments
Open

Phonon-related properties to be extracted #17

blokhin opened this issue Aug 20, 2020 · 0 comments

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@blokhin
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blokhin commented Aug 20, 2020

  • polarizability (alpha(re, im)), dielectric (epsilon(re, im)) and first-order electric susceptibility (chi(1)) tensors (independent components)

  • first hyperpolarizability (beta) and second electric susceptibility (chi(2)) tensors (independent components)

  • second hyperpolarizability (gamma) and third electric susceptibility (chi(3)) tensors

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