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Alternative Transformation for First-Order Energy

In the literature, however, it has most often been suggested to employ perturbation-dependent identity operators (l = U (A)U(A)) for the calculation of within the two-component DKH scheme based on the left-hand [Pg.591]

The alternative approach relies on the insertion of perturhation-dependent identity operators, which will cast the linear response expression given by Eq. (15.7) into the form [Pg.591]

In contrast to the direct DKH transformation in section 15.3.3.1, the alternative transformation with U = U(A) gives rise to additional terms which are not present in Eq. (15.60). In particular, terms containing energy-damped property operators X are present in Eqs. (15.73) and (15.74) and lead to much more complicated expressions compared to the direct transformation with U = U V). For example, already the first-order even term of the transformed property operator is modified as compared to Eq. (15.65) and reads [Pg.592]


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Alternative energy

Energy first

Energy first order

Energy transformation

For transformations

Order transformation

Ordering energy

Transformation first-order

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