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Samuel A. Giuliani

Publications and source records attributed to Samuel A. Giuliani.

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Impact of nuclear masses on r-process nucleosynthesis: bulk properties versus shell effects

We investigate the impact of the model estimating the masses of exotic nuclei on r-process nucleosynthesis, assessing the dependence of the abundance distribution on the specific properties of nuclear masses. By decomposing theoretical nuclear mass predictions into a liquid-drop parametrization and local shell effects, we show that r-process abundances are virtually insensitive to large variations of the masses which originate from nuclear bulk properties of the model, such as the symmetry energy. In contrast, the mass component associated with local shell effects is the main driver of r-process abundance variations, despite its relatively minor contribution to the absolute value of neutron separation energies. Our work suggests that experimental and theoretical studies of masses devoted to r-process applications, such as the nucleosynthesis in the ejecta of neutron star mergers, should focus on the physical origin and determination of local changes in mass trends.

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Multimodal fission from self-consistent calculations

When multiple fission modes coexist in a given nucleus, distinct fragment yield distributions appear. Multimodal fission has been observed in a number of fissioning nuclei spanning the nuclear chart, and this phenomenon is expected to affect the nuclear abundances synthesized during the rapid neutron-capture process (r-process). In this study, we generalize the previously proposed hybrid model for fission-fragment yield distributions to predict competing fission modes and estimate the resulting yield distributions. Our framework allows for a comprehensive large-scale calculation of fission fragment yields suited for r-process nuclear network studies. Nuclear density functional theory is employed to obtain the potential energy and collective inertia tensor on a multidimensional collective space defined by mass multipole moments. Fission pathways and their relative probabilities are determined using the nudged elastic band method. Based on this information, mass and charge fission yields are predicted using the recently developed hybrid model. Fission properties of fermium isotopes are calculated in the axial quadrupole-octupole collective space for three energy density functionals (EDFs). Disagreement between the EDFs appears when multiple fission modes are present. Within our framework, the UNEDF1$_{\textrm{HFB}}$ EDF agrees best with experimental data. Calculations in the axial quadrupole-octupole-hexadecapole collective space improve the agreement with the experiment for SkM$^{*}$. We also discuss the sensitivity of fission predictions on the choice of EDF for several superheavy nuclei. Fission fragment yield predictions for nuclei with multiple fission modes are sensitive to the underlying EDF. For large-scale calculations in which a minimal number of collective coordinates is considered, UNEDF1$_{\textrm{HFB}}$ provides the best description of experimental data.

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Neural Network Emulation of Spontaneous Fission

Large-scale computations of fission properties are an important ingredient for nuclear reaction network calculations simulating rapid neutron-capture process (the r process) nucleosynthesis. Due to the large number of fissioning nuclei contributing to the r process, a microscopic description of fission based on nuclear density functional theory (DFT) is computationally challenging. We explore the use of neural networks (NNs) to construct DFT emulators capable of predicting potential energy surfaces and collective inertia tensors across the whole nuclear chart. We use constrained Hartree-Fock-Boguliubov (HFB) calculations to predict the potential energy and collective inertia tensor in the axial quadrupole and octupole collective coordinates, for a set of nuclei in the r-process region. We then employ NNs to emulate the HFB energy and collective inertia tensor across the considered region of the nuclear chart. Least-action pathways characterizing spontaneous fission half-lives and fragment yields are obtained using the nudged elastic band method. The potential energy predicted by NNs agrees with the DFT value to within a root-mean-square error of 500 keV, and the collective inertia components agree to within an order of magnitude. The exit points on the outer turning line are found to be well emulated. For the spontaneous fission half-lives the NN emulation provides values that are found to agree with the DFT predictions within a factor of $10^3$ across more than 70 orders of magnitude. Neural networks are able to emulate the potential energy and collective inertia well enough to reasonably predict physical observables. Future directions of study, such as the inclusion of additional collective degrees of freedom and active learning, will improve the predictive power of microscopic theory and further enable large-scale fission studies.

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Cluster properties of heavy nuclei predicted with the Barcelona-Catania-Paris-Madrid energy density functional

We study the cluster emission properties of 224Ra and 238Pu employing the Barcelona-Catania-Paris-Madrid (BCPM) energy density functional (EDF). Starting from two-dimensional potential energy surfaces, coexisting fission paths are identified. A fission valley located at large octupole deformations, corresponding to a highly-asymmetric mass distribution, is found in both nuclei. As the corresponding fragments are dominated by the presence of 208Pb, we can relate this fission path to the emergence of cluster emission. Using the octupole moment as collective degree of freedom, we compute the cluster decay half-lives and study the impact of collective inertias, pairing strength and collective zero-point energy. The agreement with experimental data resembles the results obtained for spontaneous fission half-lives, indicating the capability of BCPM to consistently describe a large variety of fission phenomena, including cluster emission.

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Theoretical description of fission yields: towards a fast and efficient global model

Background: A quantitative microscopic understanding of the fission-fragment yield distributions represents a major challenge for nuclear theory as it involves the intricate competition between large-amplitude nuclear collective motion and single-particle nucleonic motion. Purpose: A recently proposed approach to global modeling of fission fragment distributions is extended to account for odd-even staggering in charge yields and for neutron evaporation. Method: Fission trajectories are obtained within the density functional theory framework, allowing for a microscopic determination of the most probable fission prefragment configurations. Mass and charge yields distributions are constructed by means of a statistical approach rooted in a microcanonical ensemble. Result: We show that the proposed hybrid model can reproduce experimental mass and charge fragment yields, including the odd-even staggering, for a wide range of fissioning nuclei. Experimental isotopic yields can be described within a simple neutron evaporation scheme. We also explore fission fragment distributions of exotic neutron-rich and superheavy systems, and compare our predictions with other state-of-the art global calculations. Conclusion: Our study suggests that the microscopic rearrangement of nucleons into fission fragments occurs well before the scission, and that the subsequent dynamics is mainly driven by the thermal excitations and bulk features of the nuclear binding. The proposed simple hybrid approach is well suited for large-scale calculations involving hundreds of fissioning nuclei.

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Fission and the r-process nucleosynthesis of translead nuclei in neutron star mergers

We study the impact of fission on the production and destruction of translead nuclei during the r-process nucleosynthesis occurring in neutron-star mergers. Abundance patterns and rates of nuclear energy production are obtained for different ejecta conditions using three sets of stellar reaction rates, one of which is based on microscopic and consistent calculations of nuclear masses, fission barriers, and collective inertias. We show that the accumulation of fissioning material during the r process can strongly affect the free neutron abundance after the r-process freeze-out. This leads to a significant impact on the abundances of heavy nuclei that undergo $α$ decay or spontaneous fission, affecting the radioactive energy production by the ejecta at timescales relevant for kilonova emission.

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Efficient method for estimation of fission fragment yields of r-process nuclei

$\textbf{Background}$ More than half of all the elements heavier than iron are made by the rapid neutron capture process (or r process). For very neutron-rich astrophysical conditions, such at those found in the tidal ejecta of neutron stars, nuclear fission determines the r-process endpoint, and the fission fragment yields shape the final abundances of $110\le A \le 170$ nuclei. The knowledge of fission fragment yields of hundreds of nuclei inhabiting very neutron-rich regions of the nuclear landscape is thus crucial for the modeling of heavy-element nucleosynthesis. $\textbf{Purpose}$ In this study, we propose a model for the fast calculation of fission fragment yields based on the concept of shell-stabilized prefragments defined with help of the nucleonic localization functions. $\textbf{Methods}$ To generate realistic potential energy surfaces and nucleonic localizations, we apply Skyrme Density Functional Theory. The distribution of the neck nucleons among the two prefragments is obtained by means of a statistical model. $\textbf{Results}$ We benchmark the method by studying the fission yields of $^{178}$Pt, $^{240}$Pu, $^{254}$Cf, and $^{254,256,258}$Fm and show that it satisfactorily explains the experimental data. We then make predictions for $^{254}$Pu and $^{290}$Fm as two representative cases of fissioning nuclei that are expected to significantly contribute during the r-process nucleosynthesis occurring in neutron star mergers. $\textbf{Conclusions}$ The proposed framework provides an efficient alternative to microscopic approaches based on the evolution of the system in a space of collective coordinates all the way to scission. It can be used to carry out global calculations of fission fragment distributions across the r-process region.

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Quantified limits of the nuclear landscape

The chart of the nuclides is limited by particle drip lines beyond which nuclear stability to proton or neutron emission is lost. Predicting the range of particle-bound isotopes poses an appreciable challenge for nuclear theory as it involves extreme extrapolations of nuclear masses beyond the regions where experimental information is available. Still, quantified extrapolations are crucial for a variety of applications, including the modeling of stellar nucleosynthesis. We use microscopic nuclear mass models and Bayesian methodology to provide quantified predictions of proton and neutron separation energies as well as Bayesian probabilities of existence throughout the nuclear landscape all the way to the particle drip lines. We apply nuclear density functional theory with several energy density functionals. To account for uncertainties, Bayesian Gaussian processes are trained on the separation-energy residuals for each individual model, and the resulting predictions are combined via Bayesian model averaging. This framework allows to account for systematic and statistical uncertainties and propagate them to extrapolative predictions. We characterize the drip-line regions where the probability that the nucleus is particle-bound decreases from $1$ to $0$. In these regions, we provide quantified predictions for one- and two-nucleon separation energies. According to our Bayesian model averaging analysis, 7759 nuclei with $Z\leq 119$ have a probability of existence $\geq 0.5$. The extrapolations obtained in this study will be put through stringent tests when new experimental information on exotic nuclei becomes available. In this respect, the quantified landscape of nuclear existence obtained in this study should be viewed as a dynamical prediction that will be fine-tuned when new experimental information and improved global mass models become available.

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Cluster radioactivity of $^{294}_{118}$Og$_{176}$

According to theory, cluster radioactivity becomes an important decay mode in superheavy nuclei. In this work, we predict that the strongly-asymmetric fission, or cluster emission, is in fact the dominant fission channel for $^{294}_{118}$Og$_{176}$, which is currently the heaviest synthetic isotope known. Our theoretical approach incorporates important features of fission dynamics, including quantum tunneling and stochastic dynamics up to scission. We show that, despite appreciable differences in static fission properties such as fission barriers and spontaneous fission lifetimes, the prediction of cluster radioactivity in $^{294}_{118}$Og$_{176}$ is robust with respect to the details of calculations, including the choice of energy density functional, collective inertia, and the strength of the dissipation term.

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Non-perturbative collective inertias for fission: a comparative study

The non-perturbative method to compute Adiabatic Time Dependent Hartree Fock Bogoliubov (ATDHFB) collective inertias is extended to the Generator Coordinate Method (GCM) including the case of density dependent forces. The two inertias schemes are computed along the fission path of the $^{234}$U and compared with the perturbative results. We find that the non-perturbative schemes predict very similar collective inertias with a much richer structure than the one predicted by perturbative calculations. Moreover, the non-perturbative inertias show an extraordinary similitude with the exact GCM inertias computed numerically from the energy overlap. These results indicate that the non-perturbative inertias provide the right structure as a function of the collective variable and only a phenomenological factor is required to mock up the exact GCM inertia, bringing new soundness to the microscopic description of fission.

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FRIB and the GW170817 Kilonova

In July 2018 an FRIB Theory Alliance program was held on the implications of GW170817 and its associated kilonova for r-process nucleosynthesis. Topics of discussion included the astrophysical and nuclear physics uncertainties in the interpretation of the GW170817 kilonova, what we can learn about the astrophysical site or sites of the r process from this event, and the advances in nuclear experiment and theory most crucial to pursue in light of the new data. Here we compile a selection of scientific contributions to the workshop, broadly representative of progress in r-process studies since the GW170817 event.

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Fission properties of superheavy nuclei for r-process calculations

We computed a new set of static fission properties suited for r-process calculations. The potential energy surfaces and collective inertias of 3640 nuclei in the superheavy region are obtained from Self-Consistent Mean-Field calculations using the Barcelona-Catania-Paris-Madrid energy density functional. The fission path is computed as a function of the quadrupole moment by minimizing the potential energy and exploring octupole and hexadecapole deformations. The spontaneous fission lifetimes are evaluated employing different schemes for the collective inertias and vibrational energy corrections. This allows to explore the sensitivity of the lifetimes to those quantities together with the collective ground state energy along the superheavy landscape. We computed neutron induced stellar reaction rates relevant for r-process nucleosynthesis using the statistical approach and study the impact of collective inertias. The competition between different reaction channels including neutron induced rates, spontaneous fission and alpha decay is discussed for typical r-process conditions.

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Dynamic versus static fission paths with realistic interactions

The properties of dynamic (least action) fission paths are analyzed and compared to the ones of the more traditional static (least energy) paths. Both the BCPM and Gogny D1M energy density functionals are used in the calculation of the HFB constrained configurations providing the potential energy and collective inertias. The action is computed as in the WKB method. A full variational search of the least-action path over the complete variational space of HFB wave functions is cumbersome and probably unnecessary if the relevant degrees of freedom are identified. In this paper, we consider the particle number fluctuation degree of freedom that explores the amount of pairing correlations in the wave function. For a given shape, the minimum action can be up a factor of three smaller than the action computed for the minimum energy state with the same shape. The impact of this reduction on the lifetimes is enormous and dramatically improves the agreement with experimental data in the few examples considered.

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Fission properties of the BCPM functional

We explore the properties of the Barcelona Catania Paris Madrid (BCPM) energy density functional concerning fission dynamics. Potential energy surfaces as well as collective inertias relevant in the fission process are computed for several nuclei where experimental data exists. Inner and outer barrier heights as well as fission isomer excitation energies are reproduced quite well in all the cases. The spontaneous fission half lives $t_{\textrm{\textrm{SF}}}$ are also computed using the standard semiclassical approach and the results are compared with the experimental data. A reasonable agreement with experiment is found over a range of 27 orders of magnitude but the theoretical predictions suffer from large uncertainties associated to the values of the parameters entering the spontaneous fission half life formula. The impact that increasing the pairing correlations strengths has in the spontaneous fission half lives is analyzed and found to be large in all the nuclei considered. Given the satisfactory description of the trend of fission properties with mass number we explore the fission properties of the even-even uranium isotope chain from $^{226}$U to $^{282}$U. Very large half lives are found when getting close to neutron number N=184.

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