期刊
CHEMICAL PHYSICS LETTERS
卷 365, 期 5-6, 页码 450-456出版社
ELSEVIER SCIENCE BV
DOI: 10.1016/S0009-2614(02)01449-5
关键词
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In this Letter we extend the perturbed matrix method by explicitly including the nuclear degrees of freedom and showing how to treat a non-homogeneous electric field. In a previous Letter we showed that this method provides reliable perturbed energies. In the present Letter we evaluate a more sophisticated property such as molecular polarizability for a water molecule. (C) 2002 Elsevier Science B.V. All rights reserved.
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