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General Questions and Answers / Re: Unit trouble dipole moments
« on: May 2, 2024, 09:52 »
Thank you for the response, but should polarization then not be a good property to calculate for a monolayer? Or is that best for a bulk material? I have tried running it but again I get mysteriously large values, in fact almost the same as when I do the dipole over the volume. That makes me question, is the polarization actually calculated through the dipole as in the scripts?