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K. Godbey

Publications and source records attributed to K. Godbey.

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Cluster model of 12C in density functional theory framework

We employ the constrained density functional theory to investigate cluster phenomena for the $^{12}$C nucleus. The proton and neutron densities are generated from the placement of three $^{4}$He nuclei (alpha particles) geometrically. These densities are then used in a density constrained Hartree-Fock calculation that produces an antisymmetrized state with the same densities through energy minimization. In the calculations no \textit{a priori} analytic form for the single-particle states is assumed and the full energy density functional is utilized. The geometrical scan of the energy landscape provides the ground state of $^{12}$C as an equilateral triangular configuration of three alphas with molecular bond like structures. The use of the nucleon localization function provides further insight to these configurations. One can conclude that these configurations are a hybrid between a pure mean-field and a pure alpha particle condensate. This development could facilitate DFT based fusion calculations with a more realistic $^{12}$C ground state.

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Impact of tensor force on quantum shell effects in quasifission reactions

Quantum shell effects drive many aspects of many-body quantal systems and their interactions. Among these are the quasifission reactions that impede the formation of a compound nucleus in superheavy element (SHE) searches. Fragment production in quasifission is influenced by shell effects as a nontrivial manifestation of microscopic dynamics hindering the full equilibration of the composite system to form the compound nucleus. In this Letter, we use the microscopic time-dependent Hartree-Fock (TDHF) theory to study 48Ca+249Bk collisions to investigate the influence of the tensor component of the effective nucleon-nucleon interaction. The results show that the inclusion of the tensor force causes the spherical shell effect to become more prominent, particularly for the neutron number yield whose peak is exactly at magic number N = 126. This suggests that the tensor force plays a compelling role in the evolution of dynamical shell effects in nuclear reactions, influencing the competition between spherical and deformed shell gaps.

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Theoretical Uncertainty Quantification for Heavy-ion Fusion

Despite recent advances and focus on rigorous uncertainty quantification for microscopic models of quantum many-body systems, the uncertainty on the dynamics of those systems has been under-explored. To address this, we have used time-dependent Hartree-Fock to examine the model uncertainty for a collection of low-energy, heavy-ion fusion reactions. Fusion reactions at near-barrier energies represent a rich test-bed for the dynamics of quantum many-body systems owing to the complex interplay of collective excitation, transfer, and static effects that determine the fusion probability of a given system. While the model uncertainty is sizable for many of the systems studied, the primary contribution comes from ill-constrained static properties, such as the neutron radius of neutron-rich nuclei. These large uncertainties motivate the use of information from reactions to better constrain existing models and to infer static properties from reaction data.

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Comparison of fission and quasi-fission modes

Quantum shell effects are known to affect the formation of fragments in nuclear fission. Shell effects also affect quasi-fission reactions occurring in heavy-ion collisions. Systematic time-dependent Hartree-Fock simulations of 50Ca+176Yb collisions show that the mass equilibration between the fragments in quasi-fission is stopped when they reach similar properties to those in the asymmetric fission mode of the 226Th compound nucleus. Similar shell effects are then expected to determine the final repartition of nucleons between the nascent fragments in both mechanisms. Future experimental studies that could test these observations are discussed.

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Pauli energy contribution to nucleus-nucleus interaction

Background: The Pauli exclusion principle plays a crucial role as a building block of many-body quantal systems comprised of fermions. It also induces a "Pauli repulsion" in the interaction between di-nuclear systems. It has been shown in [Phys. Rev. C 95, 031601 (2017)] that the Pauli repulsion widens the nucleus-nucleus potential barrier, thus hindering sub-barrier fusion. Purpose: To investigate the proton and neutron contributions to the Pauli repulsion, both in the bare potential neglecting shape polarization and transfer between the reactants, as well as in the dynamical potential obtained by accounting for such dynamical rearrangements. Methods: As the basis of our study we utilize the Pauli kinetic energy (PKE) obtained by studying the nuclear localization function (NLF). Recently this approach has been generalized to incorporate all of the dynamical and time-odd terms present in the nuclear energy density functional. This approach is employed in the DCFHF and DC-TDHF methods. Results: The PKE spatial distribution shows that a repulsion occurs in the neck between the nuclei when they first touch. Inside the barrier, neutrons can contribute significantly more to the Pauli repulsion in neutron-rich systems. Dynamical effects tend to lower the Pauli repulsion near the barrier. Proton and neutron dynamical contributions to the PKE significantly differ inside the barrier for asymmetric collisions, which is interpreted as an effect of multinucleon transfer. Conclusions: The PKE is shown to make a significant contribution to nuclear interaction potentials. Protons and neutrons can play very different roles in both the bare potential and in the dynamical rearrangement. Further microscopic studies are required to better understand the role of transfer and to investigate the effect of pairing and deformation.

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Fission fragments intrinsic spins and their correlations

The intrinsic spins and their correlations are the least understood characteristics of fission fragments from both theoretical and experimental points of view. In many nuclear reactions the emerging fragments are typically excited and acquire an intrinsic excitation energy and an intrinsic spin depending on the type of the reactions and interaction mechanism. Both the intrinsic excitation energies and the fragments intrinsic spins and parities are controlled by the interaction mechanism and conservations laws, which lead to their correlations and determines the character of their de-excitation mechanism. We outline here a framework for the theoretical extraction of the intrinsic spin distributions of the fragments and their correlations within the fully microscopic real-time density functional theory formalism and illustrate it on the example of induced fission of $^{236}$U and $^{240}$Pu, using two nuclear energy density functionals. These fission fragment intrinsic spin distributions display new qualitative features previously not discussed in literature. Within this fully microscopic framework we extract for the first time the intrinsic spin distributions of fission fragments of $^{236}$U and $^{240}$Pu as well as the correlations of their intrinsic spins, which have been debated in literature for more than six decades with no definite conclusions so far.

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Timescales of quantum equilibration, dissipation and fluctuation in nuclear collisions

Understanding the dynamics of equilibration processes in quantum systems as well as their interplay with dissipation and fluctuation is a major challenge in quantum many-body theory. The timescales of such processes are investigated in collisions of atomic nuclei using fully microscopic approaches. Results from time-dependent Hartree-Fock (TDHF) and time-dependent random-phase approximation (TDRPA) calculations are compared for 13 systems over a broad range of energies. The timescale for full mass equilibration ($\sim2\times10^{-20}$s) is found to be much larger than timescales for neutron-to-proton equilibration, kinetic energy and angular momentum dissipations which are on the order of $10^{-21}$s. Fluctuations of mass numbers in the fragments and correlations between their neutron and proton numbers build up within only a few $10^{-21}$s. This indicates that dissipation is basically not impacted by mass equilibration, but is mostly driven by the exchange of nucleons between the fragments.

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Quasifission dynamics in microscopic theories

In the search for superheavy elements quasifission reactions represent one of the reaction pathways that curtail the formation of an evaporation residue. In addition to its importance in these searches quasifission is also an interesting dynamic process that could assist our understanding of many-body dynamical shell effects and energy dissipation thus forming a gateway between deep-inelastic reactions and fission. This manuscript gives a summary of recent progress in microscopic calculations of quasifission employing time-dependent Hartree-Fock (TDHF) theory and its extensions.

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Microscopic predictions for production of neutron rich nuclei in the reaction $^\mathbf{176}\mathbf{Yb}+{}^\mathbf{176}\mathbf{Yb}$

Background: Production of neutron-rich nuclei is of vital importance to both understanding nuclear structure far from stability and to informing astrophysical models of the rapid neutron capture process (r-process). Multinucleon transfer (MNT) in heavy-ion collisions offers a possibility to produce neutron-rich nuclei far from stability. Purpose: The $^{176}\mathrm{Yb}+{}^{176}\mathrm{Yb}$ reaction has been suggested as a potential candidate to explore the neutron-rich region surrounding the principal fragments. The current study has been conducted with the goal of providing guidance for future experiments wishing to study this (or similar) system. Methods: Time-dependent Hartree-Fock (TDHF) and its time-dependent random-phase approximation (TDRPA) extension are used to examine both scattering and MNT characteristics in $^{176}\mathrm{Yb}+{}^{176}\mathrm{Yb}$. TDRPA calculations are performed to compute fluctuations and correlations of the neutron and proton numbers, allowing for estimates of primary fragment production probabilities. Results: Both scattering results from TDHF and transfer results from the TDRPA are presented for different energies, orientations, and impact parameters. In addition to fragment composition, scattering angles and total kinetic energies, as well as correlations between these observables are presented. Conclusions: $^{176}\mathrm{Yb}+{}^{176}\mathrm{Yb}$ appears to be an interesting probe for the mid-mass neutron-rich region of the chart of nuclides. The predictions of both TDHF and TDRPA are speculative, and will benefit from future experimental results to test the validity of this approach to studying MNT in heavy, symmetric collisions.

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Influence of the tensor interaction on heavy-ion fusion cross sections

[Background] While the tensor interaction has been shown to significantly affect the nuclear structure of exotic nuclei, its influence on nuclear reactions has only recently been investigated. The primary reason for this neglect is the fact that most studies of nuclear dynamics do not include the tensor force at all in their models. Indeed, only a few Skyrme parametrizations consider the tensor interaction in parameter determination. With modern research facilities extending our ability to probe exotic nuclei, a correct description of nuclear dynamics and heavy-ion fusion is vital to both supporting and leading experimental efforts. [Method] Fusion cross sections are calculated using ion-ion potentials generated by the fully microscopic density-constrained time-dependent Hartree-Fock (DC-TDHF) method with the complete Skyrme tensor interaction. [Results] For light nuclei, the tensor force only slightly changes the sub-barrier fusion cross sections at very low energies. Heavier nuclei, however, begin to exhibit a substantial hindrance effect in the sub-barrier region. This effect is strongest in spin-unsaturated systems, though can manifest in other configurations as well. Static, ground state deformation effects of the tensor force can also affect cross sections by shifting the fusion barrier. [Conclusions] The tensor interaction has a measurable effect on the fusion cross sections of nuclei spanning the nuclear chart. The effect comes from both static effects present in the ground state and dynamic processes arising from the time evolution of the system. This motivates the development of a modern Skyrme parameter set that includes all time-odd and tensor terms and that studies moving forward should include the tensor force to ensure a more robust and complete description of nuclei.

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Deformed shell effects in $^{48}$Ca+$^{249}$Bk quasifission fragments

Background: Quasifission is the main reaction channel hindering the formation of superheavy nuclei (SHN). Its understanding will help to optimize entrance channels for SHN studies. Quasifission also provides a probe to understand the influence of shell effects in the formation of the fragments. Purpose: Investigate the role of shell effects in quasifission and their interplay with the orientation of the deformed target in the entrance channel. Methods: $^{48}$Ca$+^{249}$Bk collisions are studied with the time-dependent Hartree-Fock approach for a range of angular momenta and orientations. Results: Unlike similar reactions with a $^{238}$U target, no significant shell effects which could be attributed to $^{208}$Pb "doubly-magic" nucleus are found. However, the octupole deformed shell gap at $N=56$ seems to strongly influence quasifission in the most central collisions. Conclusions: Shell effects similar to those observed in fission affect the formation of quasifission fragments. Mass-angle correlations could be used to experimentally isolate the fragments influenced by $N=56$ octupole shell gaps.

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Absence of hindrance in microscopic $^{12}$C+$^{12}$C fusion study

Background: Studies of low-energy fusion of light nuclei are important in astrophysical modeling, with small variations in reaction rates having a large impact on nucleosynthesis yields. Due to the lack of experimental data at astrophysical energies, extrapolation and microscopic methods are needed to model fusion probabilities. Purpose: To investigate deep sub-barrier $^{12}$C+$^{12}$C fusion cross sections and establish trends for the $S$ factor. Method: Microscopic methods based on static Hartree-Fock (HF) and time-dependent Hartree-Fock (TDHF) mean-field theory are used to obtain $^{12}$C+$^{12}$C ion-ion fusion potentials. Fusion cross sections and astrophysical $S$ factors are then calculated using the incoming wave boundary condition (IWBC) method. Results: Both density-constrained frozen Hartree-Fock (DCFHF) and density-constrained TDHF (DC-TDHF) predict a rising $S$ factor at low energies, with DC-TDHF predicting a slight damping in the deep sub-barrier region ($\approx1$~MeV). Comparison between DC-TDHF calculations and maximum experimental cross-sections in the resonance peaks are good. However the discrepancy in experimental low energy results inhibits interpretation of the trend. Conclusions: Using the fully microscopic DCFHF and DC-TDHF methods, no $S$ factor maximum is observed in the $^{12}$C+$^{12}$C fusion reaction. In addition, no extreme sub-barrier hindrance is predicted at low energies. The development of a microscopic theory of fusion including resonance effects, as well as further experiments at lower energies must be done before the deep sub-barrier behavior of the reaction can be established.

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Equilibration dynamics and isospin effects in nuclear reactions

We discuss equilibration times and isospin effect for various quantities in low-energy heavy-ion reactions. These include equilibration of mass, isospin, and total kinetic energy (TKE) in quasifission and deep-inelastic reactions. The calculations are performed using the time-dependent Hartree-Fock theory. The influence of shell effects on the equilibration times are also discussed in the context of theoretical and experimental results.

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The influence of tensor force on the microscopic heavy-ion interaction potential

Background: The tensor interaction is known to play an important role in the nuclear structure studies of exotic nuclei. However, most microscopic studies of low-energy nuclear reactions neglect the tensor force, resulting in a lack of knowledge concerning the effect of the tensor force on HIC...... Purpose: The theoretical study of the influence of the tensor force on heavy-ion interaction potentials is required to further our understanding of the microscopic mechanisms entailed in fusion dynamics. Method: The full Skyrme tensor force is implemented into the static Hartree-Fock and dynamic density-constrained time-dependent Hartree-Fock (DC-TDHF) theory to calculate both static (frozen density) and dynamic microscopic interaction potentials for reactions involving exotic and stable nuclei. Results: The static potentials are found to be systematically higher than the dynamical results, which are attributed to the microscopic dynamical effects included in TDHF. We also show that the dynamical potential barriers vary more significantly by the inclusion of tensor force than the static barriers. The influence of isoscalar and isovector tensor terms is also investigated with the TIJ set of forces. For light systems, the tensor force is found to have an imperceptible effect on the nucleus-nucleus potential. However, for medium and heavy spin-unsaturated reactions, the potentials may change from a fraction of an MeV to almost 2 MeV by the inclusion of tensor force, indicating a strong impact of the tensor force on sub-barrier fusion. Conclusions: The tensor force could indeed play a large role in the fusion of nuclei, with spin-unsaturated systems seeing a systematic increase in ion-ion barrier height and width. This fusion hindrance is partly due to static, ground state effects from the inclusion of the tensor force, though additional hindrance appears when studying nuclear dynamics.

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Effect of Pauli repulsion and transfer on fusion

The effect of the Pauli exclusion principle on the nucleus-nucleus bare potential is studied using a new density-constrained extension of the Frozen-Hartree-Fock (DCFHF) technique. The resulting potentials exhibit a repulsion at short distance. The charge product dependence of this Pauli repulsion is investigated. Dynamical effects are then included in the potential with the density-constrained time-dependent Hartree-Fock (DCTDHF) method. In particular, isovector contributions to this potential are used to investigate the role of transfer on fusion, resulting in a lowering of the inner part of the potential for systems with positive Q-value transfer channels.

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How the Pauli exclusion principle affects fusion of atomic nuclei

The Pauli exclusion principle induces a repulsion between composite systems of identical fermions such as colliding atomic nuclei. Our goal is to study how heavy-ion fusion is impacted by this "Pauli repulsion". We propose a new microscopic approach, the density-constrained frozen Hartree-Fock method, to compute the bare potential including the Pauli exclusion principle exactly. Pauli repulsion is shown to be important inside the barrier radius and increases with the charge product of the nuclei. Its main effect is to reduce tunnelling probability. Pauli repulsion is part of the solution to the long-standing deep sub-barrier fusion hindrance problem.

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Dependence of fusion on isospin dynamics

We introduce a new microscopic approach to calculate the dependence of fusion barriers and cross-sections on isospin dynamics. The method is based on the time-dependent Hartree-Fock theory and the isoscalar and isovector properties of the energy density functional (EDF). The contribution to the fusion barriers originating from the isoscalar and isovector parts of the EDF is calculated. It is shown that for non-symmetric systems the isovector dynamics influence the sub-barrier fusion cross-sections. For most systems this results in an enhancement of the sub-barrier cross-sections, while for others we observe differing degrees of hindrance. We use this approach to provide an explanation of recently measured fusion cross sections which show a surprising enhancement at low $E_\mathrm{c.m.}$ energies for the system $^{40}$Ca+$^{132}$Sn as compared to the more neutron-rich system $^{48}$Ca+$^{132}$Sn, and discuss the dependence of sub-barrier fusion cross-sections on transfer.

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