[Pw_forum] Polarizability calculation
annetindele at yahoo.fr
Mon May 2 14:11:28 CEST 2016
Dear allI am trying to determine the electric dipole polarizability of C60.
Using Phonon, I got a single value, whereas whit TDDFPT the dipole polarizability for each value of the frequency is a 3*3 matrix. I would like
to know if the tow calculations are equivalent. If there are, How can I move from the matrix to the single value.
Anne Justine ETINDELE
Higher Teachers Training College University of Yaounde I P.O. Box 47 Yaounde
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