We are now in a position to discuss the CE for the NLO quasilocal functional introduced by Carlsson et al. [Carlsson et al.(2008)Carlsson, Dobaczewski, and Kortelainen]. By imposing on the functional the gauge-invariance conditions, we can then confirm and explicitly rederive the results of Sec. 2.2. The explicit derivation will also allow us to discuss the CEs for densities in other spin-isospin channels analyzed in Sec. 2.2.2.
Below we consider the EDF given in terms of a local integral
of the energy density
,
The quasilocal NLO EDF was constructed [Carlsson et al.(2008)Carlsson, Dobaczewski, and Kortelainen] by building the and potential-energy densities from isoscalar and isovector densities, respectively, and their derivatives up to sixth order. For clarity, we give here a brief summary of definitions and notations used in this construction.
The local higher-order primary densities are defined by the coupling
of relative-momentum tensors [Carlsson et al.(2008)Carlsson,
Dobaczewski, and Kortelainen] with nonlocal
densities (29) to total angular momentum , that is,
We note here that the definition of the isovector terms depends on whether one uses Cartesian or spherical representation of tensors in isospace. On the one hand, the use of the standard Cartesian representation, see, e.g., Refs. [16,Carlsson et al.(2008)Carlsson, Dobaczewski, and Kortelainen], implies that the isovector terms depend on products of differences of neutron and proton densities. On the other hand, the use of the spherical representation, which was assumed in Ref. [Raimondi et al.(2011)Raimondi, Carlsson, and Dobaczewski] and is also used in the present study, involves the coupling of two isovectors to a scalar, whereby there appears a Clebsch-Gordan coefficient of . Therefore, for the isospace spherical representation, the isovector coupling constants are by the factor of larger than those for the Cartesian representation.
In the remaining part of this section, we employ the compact notation
introduced in Ref. [11], whereby the grouped indices, such
as the Greek indices
and the Roman
indices
, denote all the quantum numbers of
the local densities
and derivative operators
, respectively. In this notation, the NLO
potential-energy density of Eq. (33) reads
Our following discussion of the CE is mainly focused on the
one-body potential-energy term, defined in Eq. (16) as
the variation of the potential energy with respect to the density
matrix. For the NLO functional, this term was derived
in Ref. [11], where it was shown that in space coordinates
it has the form of a one-body pseudopotential,
In turn, potentials
were derived as linear combinations
of the secondary densities,
For the one-body pseudopotential (37),
the Schrödinger equation that gives the time evolution of
single-particle Kohn-Sham wave functions in space coordinates reads,
Before we proceed, we must first consider the complex-conjugated
pseudopotential
. To this
end, we use the property of the Biedenharn-Rose phase convention employed in
Refs. [Carlsson et al.(2008)Carlsson,
Dobaczewski, and Kortelainen,11], by which all scalars are always real.
Note that for the spherical representation of Pauli matrices,
the Biedenharn-Rose phase convention implies the transposition
of spin indices, that is,
Finally, in Eqs. (38) and (39), the complex
conjugation only affects coefficients
[11],
which gives,
We are now in a position to separate the four
spin-isospin channels in Eq. (41). We do so by multiplying both sides of the
equation with
and
summing over
. From Eq. (29)
it is then obvious that, in close analogy to Sec. 2.1,
after setting
, we obtain the CEs (30)
in the four spin-isospin channels,
provided terms coming from one-body pseudopotentials do
not contribute, as in Eq. (46). When evaluating this
condition for the four spin-isospin channels, we use the
expression for the trace of three Paul matrices in spherical
representation, which reads [17],