Title of article
On the nonexistence of strictly diabatic molecular electronic bases
Author/Authors
Kendrick، نويسنده , , Brian K and Alden Mead، نويسنده , , C and Truhlar، نويسنده , , Donald G، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2000
Pages
4
From page
629
To page
632
Abstract
In a recent publication (M. Baer, A. Alijah, Chem. Phys. Lett. 319 (2000) 489), it is proposed that, contrary to a number of statements in the literature, it may indeed be possible to construct strictly diabatic electronic basis sets in molecular systems. We show that the result of Baer and Alijah is invalid.
Journal title
Chemical Physics Letters
Serial Year
2000
Journal title
Chemical Physics Letters
Record number
1773903
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