Title of article
Charge redistribution and electronic polarization in organic molecular crystals
Author/Authors
Soos، نويسنده , , Z.G. and Tsiper، نويسنده , , E.V. and Pascal Jr.، نويسنده , , R.A.، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2001
Pages
7
From page
652
To page
658
Abstract
The electronic polarization of organic molecular crystals is obtained using the atom–atom polarizability tensor and charge redistribution in addition to previous theory based on induced dipoles. The dielectric tensors of anthracene and perylenetetracarboxylic acid dianhydride (PTCDA) crystals are successfully related to molecular polarizabilities.
Journal title
Chemical Physics Letters
Serial Year
2001
Journal title
Chemical Physics Letters
Record number
1776819
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