Title of article
Multireference self-consistent size-consistent configuration interaction method. A few applications to ground and excited states
Author/Authors
Meller، نويسنده , , J. and Malrieu، نويسنده , , J.P. and Heully، نويسنده , , J.L.، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1995
Pages
8
From page
440
To page
447
Abstract
The state-specific self-consistent dressing of a multireference CI matrix and a simplified scheme of MRCEPA(0) type are tested on a series of benchmark problems (H4, H2O, CH2+). The method is demonstrated to be strictly separable provided that the reference space is separable (i.e. it contains all products of localized reference states). The content of the method and its results are compared to those of other size-consistent multireference schemes.
Journal title
Chemical Physics Letters
Serial Year
1995
Journal title
Chemical Physics Letters
Record number
1775047
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