3.1. Properties of Odd–Even Sr Isotopes
In
Figure 1 and
Figure 2, the spectra of odd–even Sr isotopes are presented compared to the experimental data. Those were taken from ENSDF [
29] for
Sr, while the level schemes established recently for
Sr in [
22] are plotted in
Figure 2, supplemented by the candidates for the characteristic
excitation taken from [
29].
Each of the experimentally established levels finds its counterpart in the shell model calculations within a maximum of 250 keV. The rms deviation for the ensemble of levels shown in
Figure 1,
Figure 2,
Figure 3 and
Figure 4 is only 140 keV, which confirms the good quality of the present interaction. On the other hand, more levels are predicted by the theory than assigned experimentally, and various possibilities are not excluded for the spin/parity assignments of a few levels.
To investigate further the single-particle structures in Sr isotopes, the spectroscopic factors were computed in
Sr, to be compared with the data obtained in [
21,
22,
30]. They are summarized in
Table 1. For
Sr, two sets of data are listed (from different reactions), which correspond to one-neutron removal (first set) and one-neutron addition (second set) spectroscopic factors in the calculations.
As can be seen, the magnitude of the spectroscopic factors is fairly reproduced. One notices in particular that the first excited state in Sr is a core-coupled state, while the second, predicted at 2.40 MeV, carries a large spectroscopic factor. The magnitude of the spectroscopic factors in the states seems inverted between the shell model and experiment, but the “centers of gravity” based on these two states would be fairly similar. The calculated values are also close to the experiment in the case of Sr and for one-neutron addition data in Sr. The largest discrepancy was found for the and states in Sr, in the case of one-neutron removal. As the computed spectroscopic factors are too large, the occupation of these orbits in the wave function of the ground state of Sr are probably too large, as well, and higher orbitals should be better populated. The structure of the states of Sr isotopes is discussed in the next section.
In
Table 2, the occupations of the proton and neutron orbitals are listed for the low-energy excitations with
and
spin/parity. In addition to the spectroscopic factors listed above, the magnetic moments were computed for all low-energy states (using 0.7 quenching on the spin part of the
operator). They are listed along with the occupation numbers and compared to the experimental values from [
29] when possible. The agreement between theoretical and experimental magnetic moments is fairly satisfying. Note that the 213 keV level in
Sr was assigned as
in ENSDF, while it was suggested to be
in [
22], which agrees better with shell model predictions.
As can be noted, the neutron occupations reveal a clearly single-particle structure for the ground state and the first
state in
Sr. The occupation of the
in the
and of the
in the
is of the order of
; thus, those states mostly result from the coupling of the odd neutron to proton excited states. The first
state, with no particle in
, was predicted due to a coupling of the proton
with the
neutron with a
probability. The occupation of the
orbital grows to 0.7 particles in the second excited
(not shown in the Table) predicted at 2.4 MeV. The energy of this orbital was estimated to be around 2 MeV in the
Ni core, and its evolution with the neutron number is crucial for the development of the collectivity, as will be outlined below. Unfortunately, no experimental information on its position is currently available beyond
from the experimentally available spectroscopic factors, as seen from
Table 1. With the increasing neutron number, one observes an increase of the collectivity of the lowest states, manifested by more spread occupancies on both the proton and neutron sides. Still, up to
, the lowest excitations are based on neutrons in
orbitals. The mixing of neutrons from the
and
shells reflects the lack of a shell closure at
in Sr isotopes, which can be inferred from the
systematics. The occupation of the
orbital in the
level increases steadily from 0.3 to 1.0 particles at
. However, no experimental information on the position of the
excitation is available in this nucleus to confirm the predicted tendency. After passing the
, also the first excited states
and
have around one particle in the
and
orbitals, respectively. Nevertheless, their wave functions remain spread over many components with probabilities less than 10%.
It is worth mentioning that similar shell model calculations were carried out in [
20,
21,
22], exploring smaller configuration spaces. The present results for
Sr and
Sr seem more satisfactory in their prediction of the position of the first excited
state (see Figures 13 and 16 of [
22]). This state contains a considerable admixture of the proton
orbital, crucial for a proper description of single-particle and collective excitations in this region of nuclei. Its exclusion from the model space used in [
22] may be thus responsible for a too high position of the excited
states in
Sr.
3.2. Low-Energy Spectra of Even–Even Sr Isotopes
In
Figure 5,
Figure 6,
Figure 7 and
Figure 8, the low-energy spectra of even–even Sr between
and
are shown. The overall agreement with the experiment is very good in lighter Sr, with larger uncertainties at subshell closures. Nonetheless, the rms deviation for the levels shown is 300 keV, twice larger than for odd nuclei. In
Sr, the shell model predicts the
excitation 470 keV lower than the experiment, with
of the
configuration. The
excitation is based on the same configuration (
), but predicted closer to the experiment (within 290 keV). In addition, the
excited level in the neighboring
Rb (
Z = 37) is predicted at 1366 keV to be compared to the experimental value of 1577.9 keV, and in
Y (
Z = 39), the theoretical value is 890 keV against 909 keV experimentally. The larger disagreement for the
level should thus not be related to the position of the
orbital or the monopole part of the interaction involving it.
Interestingly, the state in Sr fits the experimental candidates much better, whether the first is the 2.21 MeV or 2.53 MeV level. Here, the component accounts for only , and one can note that the neutron configuration contributes to the wave function. The occupation of the grows from 0.21 at to 0.48 at in the states. The energy of this excitation deviates more and more with increasing neutron number, suggesting octupole collectivity starts playing a role in heavier Sr isotopes, as is the case in heavier-Z nuclei.
Another discrepancy in
Sr concerns the first excited
, predicted well below the first known state, while the second shell model
fits the experiment very well. This situation propagates along the chain; see
Figure 9. The systematics of the
states was also discussed in the previous work (see Figure 11 of [
23]), and a similar disagreement with the experiment was observed. The present calculations were performed with an improved shell model interaction, as described in
Section 2, and provide an overall better agreement with the experiment in heavier Sr compared to the calculations from [
23]. The problem of low-lying
states remains anyway. As can be seen in
Figure 9, it is the second excited
from theory that closely follows the experimental data, while the first excited theoretical
seems to have no counterpart.
Based on the data from [
23], it was not possible to clarify whether a low-energy
excitation is systematically not observed in the experiment or the shell model underestimates the energy of the first excited
state. To gain more insight into this issue, the distribution of one-particle removal spectroscopic factors was computed for the low-spin states in
Sr. The values for the lowest states are shown in
Table 3 along with the data from [
21].
The agreement between the computed and experimental spectroscopic factors is fair for the states: though the value of the ground state is slightly overshot, the differences in the magnitude among the three states are particularly well reproduced. One can thus conclude that the first three LSSM states correspond indeed to their experimental partners. This is true at least in Sr, as no such spectroscopic factors are available for . The model underestimates excitation energies, which can be due to the inaccuracies of the diagonal and non-diagonal matrix elements of pairing interactions. Such a problem was avoided in Zr isotopes where the orbitals are mostly involved in the s, contrary to Sr with large mixing in the wave functions. I note, in passing that, in recent MCSM calculations in Sr nucleus, a triaxially deformed band predicted on the state was located below 1.5 MeV, thus at a similar energy as the first excited predicted in the present calculations.
The lowest
s were also computed using the
j-coupled code with seniority truncation, which is the most efficient scheme to converge multiple
excitations in spite of the large sizes of the matrices. The composition of the
states is shown in
Figure 10. The seniority zero component decreases with mass; still, it is predicted to dominate in all
states and in all isotopes between
and
. Seniority four does not exceed
, while
are minor. Seniority
and higher components are negligible (and not shown in the figure), which explains the fast convergence of the computed states in terms of the number of broken nucleonic pairs. At
, the higher seniority components are also minor for the first two
states, but the third
changes its structure: it is dominated by
, and
reach
. This change of structure is consistent with the prediction that one of the excited
states should be deformed at
.
As for the dominating configurations, states in Sr are composed of: : of , : of , : of . Adding two neutrons in Sr, one finds the same proton components coupled to neutrons, in the same order, but with a smaller percentage. The situation changes in Sr, where an exchange of major configurations takes place: the first excited is now dominated by the component coupled to neutrons, while the second contains more of the configuration. The percentages of various components continue to drop with the neutron number until reaching less than for the dominating components in the ground state of Sr. All the states computed in this nucleus are based on the configuration with 9%, 27%, and 28%, respectively, and neutrons occupy mostly the and orbitals. It is interesting to notice that the ground state is the purest in terms of seniority, but the most fragmented over different configurations. At , the same structures in the wave functions can be found in the first two states with and . In the third , none of the configurations is privileged. Different particle–hole components do not exceed , confirming this state is the most collective of all the calculated s. At the same time, the occupation of the and orbitals doubles in this state with respect to the ground state, reaching 1.43 and 1.41 particles, respectively, a much smaller number than the occupation predicted in the deformed state in Zr within the MCSM, where the has more than three protons. Moving to , these occupations do not grow in the ground state, which is also dominated by the component, contrary to the expectations. This problem is discussed in the next section devoted to the shape change at .
Table 3 reports also the values of the spectroscopic factors for higher spin states compared to the data on
Sr. The spectroscopic factor calculated here for the
state is consistent with the experimental value, and the excitation energy of the state agrees very well. The largest discrepancy among the computed states concerns the first
level: here, the theoretical energy is 550 keV too low and the spectroscopic factor twice too large; the LSSM calculations reported in [
22] agree better in energy, but overestimate the spectroscopic factor by nearly a factor of three. The present calculations predict other excited
states in the vicinity of the experimental value with much lower spectroscopic factors. Unfortunately, experimentally, no more unambiguous spin assignments are available for the
states to compare the total strength and its distribution. As discussed before in [
23], along the Sr chain, the lowest
energy is predicted by the LSSM in
Sr. It is also in this nucleus where the
state bears some characteristics of the non-axially deformed state. On the contrary, at
, the
transitions from the
state to the
state are not particularly strong. No
excitation was reported from the MCSM in [
19], but one can expect a low-energy
state along with the prediction of a triaxial band. It would be of high interest to investigate further whether triaxiality is present or not at
and whether it could explain the magnitude of the spectroscopic factor of the
extracted from the experiment.
3.3. Collectivity in the Sr Chain towards N = 60
The early shell model works of Federman and Pittel [
31,
32,
33], in a small configuration space, pointed out the rapid decrease of the
energy around
in connection to the important role of the strong, attractive
interaction (the so-called spin–orbit partners (SOPs) mechanism). The deformation should be then established by the proton–neutron pairs in the
orbitals. This mechanism appeared however insufficient to explain the deformation in Zr isotopes in [
7], so it was concluded that orbitals from adjacent shells play a significant role in shaping the nuclei of this region. The suggestion was to add to the model space the quadrupole-driving orbitals
and
to create quasi-SU3 blocks for neutrons and protons operating in addition to two pseudo-SU3 blocks formed by the lower shells. The addition of only one of the two orbitals was shown to be possibly sufficient to reproduce the enhancement of the
value observed between
Zr and
Zr. Alternatively, it was debated if the increased population of the
at
can be due to the promotion of the particles from the extruder neutron
orbital (across the
gap); see [
34] and the references therein. This relates also to the possibility of the mapping between the proxy-SU3 approximation to the spherical shell model basis, which results in replacing the intruders of opposite parity by their de Shalit–Goldhaber partners, i.e., the
orbital by the
orbital in the present case; see [
35,
36].
In fact, the MCSM calculations presented in [
17] can provide an answer to these questions in the shell model context. The model space used in [
17] contained both
and
, as well as
orbitals. The authors discussed the role of configuration-dependent shell evolution, which confirms the original idea of Federman and Pittel on the important role of the SOP mechanism with the
and
attraction as the primary reason for the shape change. While it was not stated explicitly from which orbitals the additional quadrupole correlations came, the inspection of the effective single-particle energies (ESPEs) and occupation numbers displayed in Figure 3 of the same work provides the necessary insight. First, the proton
occupation is non-zero in the deformed states. As was shown in the island of inversion study in [
4], even a fractional occupancy of this orbital combined with a large
population can bring a substantial increase of the collectivity. The
(and to a lesser extent
) ESPEs are in the proximity of the rest of the shells as well, which fuels the quasi-SU3 mechanism suggested in [
7]. The neutron
is not shown, as it is located 12 MeV below
. The necessity of higher intruder orbits to obtain the right degree of quadrupole correlations in the shell model framework was thus confirmed in Zr isotopes. On the contrary, the importance of the
in the deformation-driving process could be ruled out based on those MCSM results.
In the previous section, the behavior of the
states was discussed. The present model predicts a correct number of low-energy
states and is sufficient to describe the systematics of the majority of yrast and non-yrast low-spin states from
to
included, as was shown in [
23]. For completeness, the
excitation energies are shown in
Figure 11. The agreement is very good in the whole chain, with the maximum difference of only 90 keV. The calculation reproduces correctly the tendency without a shell closure effect at
. One should bear in mind that the
energy increases in the neighboring
Zr, which is also present in the current calculations (
is located at 1.49 MeV). The origin of this increase and the connection to the
subshell closure is however not obvious; see as well Figure 2 of [
37] and the discussion therein. The possible origin of the increase of the
energy in
Zr was also discussed recently in [
1].
In
Figure 12, the
transitions are shown in comparison to the experimental data and other models taken from [
19]. In the calculations of the reduced transition probabilities, a
polarization charge was applied for both neutrons and protons. Note that in [
7], a
charge was employed, which appears to overestimate the transitions in Sr isotopes. One could fine-tune further the proton and neutron charges for a better agreement with the experiment on particular transitions. Nevertheless, the experimental errors are large in the transition region, and the major interest is to understand the relative differences in the magnitude of the transitions between the isotopes. The present calculations fit very well the data on lighter Sr isotopes. At
, the predicted value is close to that of the MCSM and indicates an increase of collectivity with respect to
. This comes from the large quadrupole matrix elements between the
and
orbitals, which are both well occupied due to the lack of the shell closure at
. Such an increase is in contrast with the flat behavior of the experimental values, though the shell model ones still fall within the error bars. The
from the 5DCH model with Gogny forces is three-times larger than the experiment at
. In
Sr, at
, the deviations grow: the available experimental values differ greatly from one another, though they are consistent within the error bars. The 5DCH model predicts more collectivity at
than at
. The MCSM gives the largest of all
values presented: as mentioned earlier, those calculations seem to predict the shape transition at a too low neutron number in Sr. Interestingly, the present calculation falls a bit down towards the lower of the two experimental values. Whether this behavior is correct can be further debated: as deduced before from the spectroscopic factors calculations, the ground state wave function of
Sr may not be very accurate. More experimental and theoretical effort can still be performed to provide a comprehensive picture of the coexisting forms just before the shape change at
.
After the shape change takes place at
, the MCSM value matches very well the experiment, while the 5DCH-D1S does not increase enough. In spite of that, the latter calculation reproduces correctly a set of other transitions in the same nucleus (see [
19,
24]). In the case of the present LSSM, only a fixed occupancy calculation was performed in
Sr: The occupations of the spin–orbit partners
were fixed to four and six particles, respectively, and seniority
was allowed. The
state in such a calculation is located at 284 keV, and the
transition value, shown in
Figure 12, is 1331
fm
. As seen, having an increased occupancy of these orbits (of a similar order as the resulting fully mixed MCSM calculations in Zr isotopes) leads to a great increase of the
value compared to
, but still not sufficient to match the experiment. In the
state computed without imposing occupancies (at
), there are 0.45 particles in
and 0.9 particles in
, only. The
transition is then one order of magnitude lower than in a fixed occupation calculation. Clearly, the interaction consistent with the properties of lighter Sr isotopes and a large number of other nuclei in the region does not favor configurations with many particles in the SOP to take over. This was also the case of Zr isotopes studied in the same framework, which confirms that the deformation origin is the same in both chains. The immediate conclusion is that its description requires an extra mechanism to populate the
and
orbitals. The second observation is that additional quadrupole collectivity is necessary, even if the SOPs are well occupied. Both points cannot be satisfied without extending the valence space, testifying to the crucial role of intruder orbitals in shaping nuclei in the region. It is now advisable to theoretically further investigate the shape coexistence around
towards lighter
Z nuclides. As in Kr and Se, the drops of the
energies are not as pronounced as in Sr and Zr, it is of interest to uncover the origin of this difference and to track the evolution of the intruding orbits with decreasing proton number.