arXiv subjects

T. Niksic

Publications and source records attributed to T. Niksic.

At least 19 recordsLinked to original sources

arXiv2023

Microscopic description of $α$, $2α$, and cluster decays of $^{216-220}$Rn and $^{220-224}$Ra

Alpha and cluster decays are analyzed for heavy nuclei located above $^{208}$Pb on the chart of nuclides: $^{216-220}$Rn and $^{220-224}$Ra, that are also candidates for observing the $2 α$ decay mode. A microscopic theoretical approach based on relativistic Energy Density Functionals (EDF), is used to compute axially-symmetric deformation energy surfaces as functions of quadrupole, octupole and hexadecupole collective coordinates. Dynamical least-action paths for specific decay modes are calculated on the corresponding potential energy surfaces. The effective collective inertia is determined using the perturbative cranking approximation, and zero-point and rotational energy corrections are included in the model. The predicted half-lives for $α$-decay are within one order of magnitude of the experimental values. In the case of single $α$ emission, the nuclei considered in the present study exhibit least-action paths that differ significantly up to the scission point. The differences in alpha-decay lifetimes are not only driven by Q values, but also by variances of the least-action paths prior to scission. In contrast, the $2 α$ decay mode presents very similar paths from equilibrium to scission, and the differences in lifetimes are mainly driven by the corresponding Q values. The predicted $^{14}$C cluster decay half-lives are within three orders of magnitudes of the empirical values, and point to a much more complex pattern compared to the alpha-decay mode.

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arXiv2022

Dynamical synthesis of 4He in the scission phase of nuclear fission

In the exothermic process of fission decay, an atomic nucleus splits into two or more independent fragments. Several aspects of nuclear fission are not properly understood, in particular the formation of the neck between the nascent fragments, and the subsequent mechanism of scission into two or more independent fragments. Using an implementation of time-dependent density functional theory, based on a relativistic energy density functional and including pairing correlations, we analyze the final phase of the process of induced fission of $^{240}$Pu, and show that the time-scale of neck formation coincides with the assembly of two $α$-like clusters (less than 1 zs = 10$^{-21}$ s). Because of its much larger binding energy, the dynamical synthesis of 4He in the neck predominates over other light clusters, e.g., $^3$H and $^6$He. At the instant of scission the neck ruptures exactly between the two $α$-like clusters, which separate because of the Coulomb repulsion and are eventually absorbed by the two emerging fragments. The newly proposed mechanism of light charged clusters formation at scission provides a natural explanation of ternary fission.

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arXiv2022

Microscopic analysis of induced nuclear fission dynamics

The dynamics of low-energy induced fission is explored using a consistent microscopic framework that combines the time-dependent generator coordinate method (TDGCM) and time-dependent nuclear density functional theory (TDDFT). While the former presents a fully quantum mechanical approach that describes the entire fission process as an adiabatic evolution of collective degrees of freedom, the latter models the dissipative dynamics of the final stage of fission by propagating the nucleons independently toward scission and beyond. By combining the two methods, based on the same nuclear energy density functional and pairing interaction, we perform an illustrative calculation of the charge distribution of yields and total kinetic energy for induced fission of $^{240}$Pu. For the saddle-to-scission phase a set of initial points for the TDDFT evolution is selected along an iso-energy curve beyond the outer fission barrier on the deformation energy surface, and the TDGCM is used to calculate the probability that the collective wave function reaches these points at different times. Fission observables are computed with both methods and compared with available data. The relative merits of including quantum fluctuations (TDGCM) and the one-body dissipation mechanism (TDDFT) are discussed.

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arXiv2020

Microscopic description of the self-conjugate $^{108}$Xe and $^{104}$Te $α$-decay chain

A microscopic calculation of half-lives for the recently observed $^{108}$Xe $\to$ $^{104}$Te $\to$ $^{100}$Sn $α$-decay chain is performed using a self-consistent framework based on energy density functionals. The relativistic density functional DD-PC1 and a separable pairing interaction of finite range are used to compute axially-symmetric deformation energy surfaces of $^{104}$Te and $^{108}$Xe as functions of quadrupole, octupole and hexadecupole collective coordinates. Dynamic least-action paths are determined that trace the $α$-particle emission from the equilibrium deformation to the point of scission. The calculated half-lives: 197 ns for $^{104}$Te and 50 $μ$s for $^{108}$Xe, are compared to recent experimental values of the half-lives of superallowed $α$-decay of $^{104}$Te: $< 18$ ns, and $^{108}$Xe: 58$^{+106}_{-23}$ $μ$s.

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arXiv2020

Coupling of shape and pairing vibrations in a collective Hamiltonian based on nuclear energy density functionals

The quadrupole collective Hamiltonian, based on relativistic energy density functionals, is extended to include a pairing collective coordinate. In addition to quadrupole shape vibrations and rotations, the model describes pairing vibrations and the coupling between shape and pairing degrees of freedom. The parameters of the collective Hamiltonian are determined by constrained self-consistent relativistic mean-field plus Bardeen-Cooper-Schrieffer (RMF+BCS) calculations in the space of intrinsic shape and pairing deformations. The effect of coupling between shape and pairing degrees of freedom is analyzed in a study of low-energy spectra and transition rates of four axially symmetric $N=92$ rare-earth isotones. When compared to results obtained with the standard quadrupole collective Hamiltonian, the inclusion of dynamical pairing increases the moment of inertia, lowers the energies of excited $0^+$ states and reduces the E0-transition strengths, in better agreement with data.

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arXiv2019

Microscopic core-quasiparticle coupling model for spectroscopy of odd-mass nuclei with octupole correlations

[Background] Predictions of spectroscopic properties of low-lying states are critical for nuclear structure studies. Theoretical methods can be particularly involved for odd-mass nuclei because of the interplay between the unpaired nucleon and collective degrees of freedom. Only a few models have been developed for systems in which octupole collective degrees of freedom play a role. [Purpose] We aim to predict spectroscopic properties of odd-mass nuclei characterized by octupole shape deformation, employing a model that describes single-particle and collective degrees of freedom within the same microscopic framework. [Method] A microscopic core-quasiparticle coupling (CQC) model based on the covariant density functional theory is developed, which includes collective excitations of even-mass core nuclei and single-particle states of the odd nucleon, calculated using a quadrupole-octupole collective Hamiltonian combined with a constrained reflection-asymmetric relativistic Hartree-Bogoliubov model. [Results] Model predictions for low-energy excitation spectra and transition rates of odd-mass radium isotopes $^{223, 225, 227}$Ra are shown to be in good agreement with available data. [Conclusions] A microscopic CQC model based on covariant density functional theory has been developed for odd-mass nuclei characterized by both quadrupole and octupole shape deformations. Theoretical results reproduce data in odd-mass Ra isotopes and provide useful predictions for future studies of octupole correlations in nuclei and related phenomena.

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arXiv2017

Spectroscopy of reflection-asymmetric nuclei with relativistic energy density functionals

Quadrupole and octupole deformation energy surfaces, low-energy excitation spectra and transition rates in fourteen isotopic chains: Xe, Ba, Ce, Nd, Sm, Gd, Rn, Ra, Th, U, Pu, Cm, Cf, and Fm, are systematically analyzed using a theoretical framework based on a quadrupole-octupole collective Hamiltonian (QOCH), with parameters determined by constrained reflection-asymmetric and axially-symmetric relativistic mean-field calculations. The microscopic QOCH model based on the PC-PK1 energy density functional and $δ$-interaction pairing is shown to accurately describe the empirical trend of low-energy quadrupole and octupole collective states, and predicted spectroscopic properties are consistent with recent microscopic calculations based on both relativistic and non-relativistic energy density functionals. Low-energy negative-parity bands, average octupole deformations, and transition rates show evidence for octupole collectivity in both mass regions, for which a microscopic mechanism is discussed in terms of evolution of single-nucleon orbitals with deformation.

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arXiv2017

Microscopic study of induced fission dynamics of $^{226}$Th with covariant energy density functionals

Static and dynamic aspects of the fission process of $^{226}$Th are analyzed in a self-consistent framework based on relativistic energy density functionals. Constrained relativistic mean-field (RMF) calculations in the collective space of axially symmetric quadrupole and octupole deformations, based on the energy density functional PC-PK1 and a $δ$-force pairing, are performed to determine the potential energy surface of the fissioning nucleus, the scission line, the single-nucleon wave functions, energies and occupation probabilities, as functions of deformation parameters. Induced fission dynamics is described using the time-dependent generator coordinate method in the Gaussian overlap approximation. A collective Schrödinger equation, determined entirely by the microscopic single-nucleon degrees of freedom, propagates adiabatically in time the initial wave packet built by boosting the ground-state solution of the collective Hamiltonian for $^{226}$Th. The position of the scission line and the microscopic input for the collective Hamiltonian are analyzed as functions of the strength of the pairing interaction. The effect of static pairing correlations on the pre-neutron emission charge yields and total kinetic energy of fission fragments is examined in comparison with available data, and the distribution of fission fragments is analyzed for different values of the initial excitation energy.

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arXiv2017

Global analysis of quadrupole shape invariants based on covariant energy density functionals

Coexistence of different geometric shapes at low energies presents a universal structure phenomenon that occurs over the entire chart of nuclides. Studies of the shape coexistence are important for understanding the microscopic origin of collectivity and modifications of shell structure in exotic nuclei far from stability. The aim of this work is to provide a systematic analysis of characteristic signatures of coexisting nuclear shapes in different mass regions, using a global self-consistent theoretical method based on universal energy density functionals and the quadrupole collective model. The low-energy excitation spectrum and quadrupole shape invariants of the two lowest $0^{+}$ states of even-even nuclei are obtained as solutions of a five-dimensional collective Hamiltonian (5DCH) model, with parameters determined by constrained self-consistent mean-field calculations based on the relativistic energy density functional PC-PK1, and a finite-range pairing interaction. The theoretical excitation energies of the states: $2^+_1$, $4^+_1$, $0^+_2$, $2^+_2$, $2^+_3$, as well as the $B(E2; 0^+_1\to 2^+_1)$ values, are in very good agreement with the corresponding experimental values for 621 even-even nuclei. Quadrupole shape invariants have been implemented to investigate shape coexistence, and the distribution of possible shape-coexisting nuclei is consistent with results obtained in recent theoretical studies and available data. The present analysis has shown that, when based on a universal and consistent microscopic framework of nuclear density functionals, shape invariants provide distinct indicators and reliable predictions for the occurrence of low-energy coexisting shapes. This method is particularly useful for studies of shape coexistence in regions far from stability where few data are available.

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arXiv2014

Density Functional Theory studies of cluster states in nuclei

The framework of nuclear energy density functionals is applied to a study of the formation and evolution of cluster states in nuclei. The relativistic functional DD-ME2 is used in triaxial and reflection-asymmetric relativistic Hartree-Bogoliubov calculations of relatively light $N = Z$ and neutron-rich nuclei. The role of deformation and degeneracy of single-nucleon states in the formation of clusters is analysed, and interesting cluster structures are predicted in excited configurations of Be, C, O, Ne, Mg, Si, S, Ar and Ca $N = Z$ nuclei. Cluster phenomena in neutron-rich nuclei are discussed, and it is shown that in neutron-rich Be and C nuclei cluster states occur as a result of molecular bonding of $α$-particles by the excess neutrons, and also that proton covalent bonding can occur in $^{10}$C.

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arXiv2014

DIRHB -- a relativistic self-consistent mean-field framework for atomic nuclei

The DIRHB package consists of three Fortran computer codes for the calculation of the ground-state properties of even-even atomic nuclei using the framework of relativistic self-consistent mean-field models. Each code corresponds to a particular choice of spatial symmetry: the DIRHBS, DIRHBZ and DIRHBT codes are used to calculate nuclei with spherical symmetry, axially symmetric quadrupole deformation, and triaxial quadrupole shapes, respectively. Reflection symmetry is assumed in all three cases. The latest relativistic nuclear energy density functionals are implemented in the codes, thus enabling efficient and accurate calculations over the entire nuclide chart.

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arXiv2014

Microscopic description of octupole shape-phase transitions in light actinides and rare-earth nuclei

A systematic analysis of low-lying quadrupole and octupole collective states is presented, based on the microscopic energy density functional framework. By mapping the deformation constrained self-consistent axially symmetric mean-field energy surfaces onto the equivalent Hamiltonian of the $sdf$ interacting boson model (IBM), that is, onto the energy expectation value in the boson condensate state, the Hamiltonian parameters are determined. The study is based on the global relativistic energy density functional DD-PC1. The resulting IBM Hamiltonian is used to calculate excitation spectra and transition rates for the positive- and negative-parity collective states in four isotopic chains characteristic for two regions of octupole deformation and collectivity: Th, Ra, Sm and Ba. Consistent with the empirical trend, the microscopic calculation based on the systematics of $β_{2}$-$β_{3}$ energy maps, the resulting low-lying negative-parity bands and transition rates show evidence of a shape transition between stable octupole deformation and octupole vibrations characteristic for $β_{3}$-soft potentials.

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arXiv2013

Localization and clustering in the nuclear Fermi liquid

Using the framework of nuclear energy density functionals we examine the conditions for single-nucleon localization and formation of cluster structures in finite nuclei. We propose to characterize localization by the ratio of the dispersion of single-nucleon wave functions to the average inter-nucleon distance. This parameter generally increases with mass and describes the gradual transition from a hybrid phase in light nuclei, characterized by the spatial localization of individual nucleon states that leads to the formation of cluster structures, toward the Fermi liquid phase in heavier nuclei. Values of the localization parameter that correspond to a crystal phase cannot occur in finite nuclei. Typical length and energy scales in nuclei allow the formation of liquid drops, clusters, and halo structures.

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arXiv2012

Energy Density Functional analysis of shape evolution in N=28 isotones

The structure of low-energy collective states in proton-deficient N=28 isotones is analyzed using structure models based on the relativistic energy density functional DD-PC1. The relativistic Hartree-Bogoliubov model for triaxial nuclei is used to calculate binding energy maps in the $β$-$γ$ plane. The evolution of neutron and proton single-particle levels with quadrupole deformation, and the occurrence of gaps around the Fermi surface, provide a simple microscopic interpretation of the onset of deformation and shape coexistence. Starting from self-consistent constrained energy surfaces calculated with the functional DD-PC1, a collective Hamiltonian for quadrupole vibrations and rotations is employed in the analysis of excitation spectra and transition rates of $^{46}$Ar, $^{44}$S, and $^{42}$Si. The results are compared to available data, and previous studies based either on the mean-field approach or large-scale shell-model calculations. The present study is particularly focused on $^{44}$S, for which data have recently been reported that indicate pronounced shape coexistence.

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arXiv2012

An efficient method for computing the Thouless-Valatin inertia parameters

Starting from the adiabatic time-dependent Hartree-Fock approximation (ATDHF), we propose an efficient method to calculate the Thouless-Valatin moments of inertia for the nuclear system. The method is based on the rapid convergence of the expansion of the inertia matrix. The accuracy of the proposed method is verified in the rotational case by comparing the results with the exact Thouless-Valatin moments of inertia calculated using the self-consistent cranking model. The proposed method is computationally much more efficient than the full ATDHF calculation, yet it retains a high accuracy of the order of 1%.

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arXiv2012

Relativistic Energy Density Functional Description of Shape Transition in Superheavy Nuclei

Relativistic energy density functionals (REDF) provide a complete and accurate, global description of nuclear structure phenomena. A modern semi-empirical functional, adjusted to the nuclear matter equation of state and to empirical masses of deformed nuclei, is applied to studies of shapes of superheavy nuclei. The theoretical framework is tested in a comparison of calculated masses, quadrupole deformations, and potential energy barriers to available data on actinide isotopes. Self-consistent mean-field calculations predict a variety of spherical, axial and triaxial shapes of long-lived superheavy nuclei, and their alpha-decay energies and half-lives are compared to data. A microscopic, REDF-based, quadrupole collective Hamiltonian model is used to study the effect of explicit treatment of collective correlations in the calculation of Qα values and half-lives.

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arXiv2012

How atomic nuclei cluster

Nucleonic matter displays a quantum liquid structure, but in some cases finite nuclei behave like molecules composed of clusters of protons and neutrons. Clustering is a recurrent feature in light nuclei, from beryllium to nickel. For instance, in $^{12}$C the Hoyle state, crucial for stellar nucleosynthesis, can be described as a nuclear molecule consisting of three alpha-particles. The mechanism of cluster formation, however, has not yet been fully understood. We show that the origin of clustering can be traced back to the depth of the confining nuclear potential. By employing the theoretical framework of energy density functionals that encompasses both cluster and quantum liquid-drop aspects of nuclei, it is shown that the depth of the potential determines the energy spacings between single-nucleon orbitals, the localization of the corresponding wave functions and, therefore, the degree of nucleonic density clustering. Relativistic functionals, in particular, are characterized by deep single-nucleon potentials. When compared to non-relativistic functionals that yield similar ground-state properties (binding energy, deformation, radii), they predict the occurrence of much more pronounced cluster structures. More generally, clustering is considered as a transitional phenomenon between crystalline and quantum liquid phases of fermionic systems.

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arXiv2012

Robust Regularity in γ-Soft Nuclei and its Microscopic Realization

γ-softness in atomic nuclei is investigated in the framework of energy density functionals. By mapping constrained microscopic energy surfaces for a set of representative non-axial medium-heavy and heavy nuclei to a Hamiltonian of the proton-neutron interacting boson model (IBM-2) containing up to three-body interactions, low-lying collective spectra and transition rates are calculated. Observables are analyzed that distinguish between the two limiting geometrical pictures of non-axial nuclei: the rigid-triaxial rotor and the γ-unstable rotor. It is shown that neither of these pictures is realized in actual nuclei, and that a microscopic description leads to results that are almost exactly in between the two geometrical limits. This finding points to the optimal choice of the IBM Hamiltonian for γ-soft nuclei.

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