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Ch. Elster

Publications and source records attributed to Ch. Elster.

At least 19 recordsLinked to original sources

Ab initio optical potentials for magnesium isotopes at intermediate energies: from stability to the island of inversion

We present the first calculations of ab initio nonlocal optical potentials for $^{24,26,28}$Mg and $^{32}$Mg isotopes using the leading-order term of the spectator expansion of multiple-scattering theory. We use the structure input from the ab initio symmetry-adapted no-core shell model (SA-NCSM), which provides translationally invariant, off-shell scalar and spin-projected densities so that structure and reaction inputs are treated on equal footing with no adjustable parameters. This leading-order potential reproduces $^{24}$Mg neutron total, reaction, and elastic-scattering data at energies between 65 and 250 MeV and provides predictions for $^{26,28}$Mg and $^{32}$Mg. We compare our prediction with those from uncertainty-quantified Koning-Delaroche (KDUQ) and Weppner-Penney global optical potentials, and with the ENDF nuclear data evaluations. These comparisons highlight some of the limitations of the global models, while also validating their use in reaction modeling near the N=20 island of inversion.

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Active learning emulators for nuclear two-body scattering in momentum space

We extend the active learning emulators for two-body scattering in coordinate space with error estimation, recently developed by Maldonado et al. [Phys. Rev. C 112, 024002], to coupled-channel scattering in momentum space. Our full-order model (FOM) solver is based on the Lippmann-Schwinger integral equation for the scattering $t$-matrix as opposed to the radial Schr\"odinger equation. We use (Petrov-)Galerkin projections and high-fidelity calculations at a few snapshots across the parameter space of the interaction to construct efficient reduced-order models (ROMs), trained by a greedy algorithm for locally optimal snapshot selection. Both the FOM solver and the corresponding ROMs are implemented efficiently in Python using Google's JAX library. We present results for emulating scattering phase shifts in coupled and uncoupled channels and cross sections, and assess the accuracy of the developed ROMs and their computational speedup factors. We also develop emulator error estimation for both the $t$-matrix and the total cross section. The software framework for reproducing and extending our results is publicly available. Together with our recent advances in developing active-learning emulators for three-body scattering, these emulator frameworks set the stage for full Bayesian calibrations of chiral nuclear interactions and optical models against scattering data with quantified emulator errors.

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Separable character of ab initio No-Core Shell Model one-body densities

Motivated by recent findings on the separability of optical potentials that are derived from folding off-shell densities with off-shell nucleon-nucleon amplitudes, we study the off-shell character of one-body density matrices created within the No-Core Shell Model (NCSM). Concentrating on nuclei with a 0$^+$ ground state from $^4$He through $^{48}$Ca, we investigate the off-shell character of their one-body density matrices in momentum space when using the momentum transfer and the average momentum as variables. A singular value decomposition of the one-body density matrices reveals that they can be characterized by only very few terms, depending on the mass number of the nucleus. These findings are independent of the nucleon-nucleon interactions employed, as well as from computational specifics as grid spacing and size of the model space.

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Order-by-order uncertainties of nucleon-nucleon Wolfenstein amplitudes in chiral effective field theory

Quantum mechanical invariance principles dictate the most general operator structure that can be present in the nucleon-nucleon (NN) interaction. Five independent operators appear in the on-shell NN amplitude together with five corresponding coefficient functions. The usual choice for these coefficient functions is known as the NN Wolfenstein amplitudes. We analyze the order-by-order convergence of each of the five NN Wolfenstein amplitudes predicted by a semi-local coordinate space potential implementation of chiral effective field theory ($\chi$EFT). We do this at laboratory kinetic energies between 25 and 200 MeV for both neutron-proton and proton-proton scattering. Our analysis uses the Gaussian-Process methods developed by the BUQEYE collaboration to describe the contributions of each $\chi$EFT order, and so yields truncation uncertainties for each Wolfenstein amplitude that are correlated across scattering angles. We combine information on the size of different orders in the EFT to infer the $\chi$EFT breakdown scale for each amplitude, finding, on average, $\Lambda_b$ between 750 and 800 MeV. With this choice of $\Lambda_b$, the EFT truncation uncertainties cover both higher-order results and empirical Wolfenstein amplitudes well for all orders other than the leading order.

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Ab initio leading order effective potential for elastic proton scattering based on the symmetry-adapted no-core shell model

Based on the Watson expansion of the multiple scattering series, we employ a nonlocal translationally invariant nuclear density derived within the symmetry-adapted no-core shell model (SA-NCSM) framework from a chiral next-to-next-to-leading order (NNLO) nucleon-nucleon interaction and the very same interaction for a consistent full-folding calculation of the effective (optical) potential for nucleon-nucleus scattering for medium-heavy nuclei. The leading order effective (optical) folding potential is computed by integrating over a translationally invariant SA-NCSM one-body scalar density, spin-projected momentum distribution, and the Wolfenstein amplitudes $A$, $C$, and $M$. The resulting nonlocal potentials serve as input for a momentum space Lippmann-Schwinger equation, whose solutions are summed up to obtain nucleon-nucleus scattering observables. In the SA-NCSM, the model space is systematically up-selected using $\SpR{3}$ symmetry considerations. For the light nucleus of $^6$He, we establish a systematic selection scheme in the SA-NCSM for scattering observables. Then, we apply this scheme to calculations of scattering observables, such as differential cross sections, analyzing powers, and spin rotation functions for elastic proton scattering from $^{20}$Ne and $^{40}$Ca in the energy regime between 65 and 200 MeV, and compare to available data. Our calculations show that the leading order effective nucleon-nucleus potential in the Watson expansion of multiple scattering theory obtained from an up-selected SA-NCSM model space describes $^{40}$Ca elastic scattering observables reasonably well to about 60 degrees in the center-of-mass frame, which coincides roughly with the validity of the NNLO chiral interaction used to calculate both the nucleon-nucleon amplitudes and the one-body scalar and spin nuclear densities.

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Nuclear structure and elastic scattering observables obtained consistently with different NN interactions

Nucleon-nucleon ($NN$) interactions based on chiral effective theories are commonly used in ab initio calculations of light nuclei. Here we present a study based on three different NN interactions (up to next-to-next-to-leading order) for which structure and elastic proton scattering observables are consistently calculated for $^4$He, $^{12}$C, and $^{16}$O. The interactions are compared at the two-body level in terms of Wolfenstein amplitudes, and their predictions for ground state energies, point-proton radii, and charge form factors, as well as proton elastic scattering observables in the leading-order spectator expansion in the energy range between 65 and 160 MeV projectile energy are presented. To gain further insight into differences visible in elastic scattering observables, we investigate the behavior of the calculated effective nucleon-nucleus interactions for the $^{12}$C nucleus based on the different $NN$ interactions.

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Chiral uncertainties in ab initio nucleon-nucleus elastic scattering

The effective interaction between a nucleon and a nucleus is one of the most important ingredients for reaction theories. Theoretical formulations were introduced early by Feshbach and Watson, and efforts of deriving and computing those `optical potentials' in a microscopic fashion have a long tradition. However, only recently the leading order term in the Watson multiple scattering approach could be calculated fully {\it ab initio}, meaning that the same nucleon-nucleon (NN) interaction enters both the structure as well as the reaction pieces on equal footing. This allows the uncertainties from the underlying chiral effective NN interaction to be systematically explored in nucleon-nucleus elastic scattering observables. In this contribution the main ingredients for arriving at the {\it ab initio} leading order of the effective nucleon-nucleus interaction in the Watson approach will be reviewed. Concentrating on one specific chiral NN interaction from the LENPIC collaboration and light nuclei with a 0$^+$ ground state, the leading order nucleon-nucleus interaction is calculated using up to the third chiral order (N2LO) in the nucleon-nucleon potential, and elastic scattering observables are extracted. Then pointwise as well as correlated uncertainty quantification is used for the estimation of the chiral truncation error. Elastic scattering observables for $^4$He, $^{12}$C, and $^{16}$O for between 65 and 200 MeV projectile energy will be analyzed.

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Perspectives on few-body cluster structures in exotic nuclei

It is a fascinating phenomenon in nuclear physics that states with a pronounced few-body structure can emerge from the complex dynamics of many nucleons. Such halo or cluster states often appear near the boundaries of nuclear stability. As such, they are an important part of the experimental program beginning at the Facility for Rare Isotope Beams (FRIB). A concerted effort of theory and experiment is necessary both to analyze experiments involving effective few-body states, as well as to constrain and refine theories of the nuclear force in light of new data from these experiments. As a contribution to exactly this effort, this paper compiles a collection of ``perspectives'' that emerged out of the Topical Program ``Few-body cluster structures in exotic nuclei and their role in FRIB experiments'' that was held at FRIB in August 2022 and brought together theorists and experimentalists working on this topic.

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Optical potentials for the rare-isotope beam era

We review recent progress and motivate the need for further developments in nuclear optical potentials that are widely used in the theoretical analysis of nucleon elastic scattering and reaction cross sections. In regions of the nuclear chart away from stability, which represent a frontier in nuclear science over the coming decade and which will be probed at new rare-isotope beam facilities worldwide, there is a targeted need to quantify and reduce theoretical reaction model uncertainties, especially with respect to nuclear optical potentials. We first describe the primary physics motivations for an improved description of nuclear reactions involving short-lived isotopes, focusing on its benefits for fundamental science discoveries and applications to medicine, energy, and security. We then outline the various methods in use today to build optical potentials starting from phenomenological, microscopic, and ab initio methods, highlighting in particular the strengths and weaknesses of each approach. We then discuss publicly-available tools and resources facilitating the propagation of recent progresses in the field to practitioners. Finally, we provide a set of open challenges and recommendations for the field to advance the fundamental science goals of nuclear reaction studies in the rare-isotope beam era.

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Ab initio nucleon-nucleus elastic scattering with chiral effective field theory uncertainties

Background: Effective interactions for nucleon-nucleus ($NA$) elastic scattering from first principles require the use of the same nucleon-nucleon ($NN$) interaction in the structure and reaction calculations, and a consistent treatment of the relevant operators at each order. Purpose: Truncation uncertainties of chiral $NN$ forces have been studied for scattering observables in few-body systems and for bound state properties of light nuclei. We extend this to $NA$ elastic scattering. Methods: With the spectator expansion of multiple scattering theory and the no-core shell model, we use a chiral interaction from the LENPIC collaboration to consistently calculate the leading order effective $NA$ interaction up to third chiral order (N2LO) and extract elastic scattering observables. We quantify the chiral truncation error using pointwise and correlated methods. Results: We analyze proton-$^{16}$O and neutron-$^{12}$C elastic scattering observables between 65 and 185 MeV projectile kinetic energy. We find qualitatively similar results for the chiral truncation uncertainties as in few-body systems, which we assess using similar diagnostic tools. The order-by-order convergence of the scattering observables for $^{16}$O and $^{12}$C is reasonable near 100 MeV, but for higher energies the expansion parameter becomes too large to converge. We find a near-perfect correlation between the neutron differential cross section and the $NN$ Wolfenstein amplitudes for small momentum transfers. Conclusions: The tools used to study the convergence of a chiral $NN$ interaction in few-body systems can be applied to $NA$ scattering with minor changes. The $NN$ interaction used here gives a good description of $^{16}$O and $^{12}$C scattering observables as low as 65 MeV. The very forward direction of the neutron differential cross section mirrors the behavior of the $NN$ interaction amazingly well.

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Nonlocal structure of the leading order \textit{ab initio} effective potentials for proton elastic scattering from light nuclei

Based on the spectator expansion of the multiple scattering series we employ a chiral next-to-next-to-leading order (NNLO) nucleon-nucleon interaction on the same footing in the structure as well as in the reaction calculation to obtain an in leading-order consistent effective potential for nucleon-nucleus elastic scattering, which includes the spin of the struck target nucleon. As an example we present proton scattering off $^{12}$C.

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Nuclear spin features relevant to ab initio nucleon-nucleus elastic scattering

Background: Effective interactions for elastic nucleon-nucleus scattering from first principles require the use of the same nucleon-nucleon interaction in the structure and reaction calculations, as well as a consistent treatment of the relevant operators at each order. Purpose: Previous work using these interactions has shown good agreement with available data. Here, we study the physical relevance of one of these operators, which involves the spin of the struck nucleon, and examine the interpretation of this quantity in a nuclear structure context. Methods: Using the framework of the spectator expansion and the underlying framework of the no-core shell model, we calculate and examine spin-projected, one-body momentum distributions required for effective nucleon-nucleus interactions in $J=0$ nuclear states. Results: The calculated spin-projected, one-body momentum distributions for $^4$He, $^6$He, and $^8$He display characteristic behavior based on the occupation of protons and neutrons in single particle levels, with more nucleons of one type yielding momentum distributions with larger values. Additionally, we find this quantity is strongly correlated to the magnetic moment of the $2^+$ excited state in the ground state rotational band for each nucleus considered. Conclusions: We find that spin-projected, one-body momentum distributions can probe the spin content of a $J=0$ wave function. This feature may allow future \textit{ab initio} nucleon-nucleus scattering studies to inform spin properties of the underlying nucleon-nucleon interactions. The observed correlation to the magnetic moment of excited states illustrates a previously unknown connection between reaction observables such as the analyzing power and structure observables like the magnetic moment.

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Ab initio Leading Order Effective Potentials for Elastic Nucleon-Nucleus Scattering

Background: Calculating microscopic effective interactions (optical potentials) for elastic nucleon-nucleus scattering has already in the past led to a large body of work. For first-order calculations a nucleon-nucleon (\textit{NN}) interaction and a one-body density of the nucleus were taken as input to rigorous calculations of microscopic full-folding calculations. Purpose: Based on the spectator expansion of the multiple scattering series we employ a chiral next-to-next-to-leading order (NNLO) nucleon-nucleon interaction on the same footing in the structure as well as in the reaction calculation to obtain an in leading-order consistent effective potential for nucleon-nucleus elastic scattering, which includes the spin of the struck target nucleon. Methods: The first order effective folding potential is computed by first deriving a nonlocal scalar density as well as a spin-projected momentum distribution. Those are then integrated with the off-shell Wolfenstein amplitudes $A$, $C$, and $M$. The resulting nonlocal potential serves as input to a momentum-space Lippmann-Schwinger equation, whose solutions are summed to obtain the nucleon-nucleus scattering observables. Results: We calculate elastic scattering observables for $^4$He, $^6$He, $^8$He, $^{12}$C, and $^{16}$O in the energy regime between 100 and 200 MeV projectile kinetic energy, and compare to available data. We also explore the extension down to about 70 MeV, and study the effect of ignoring the spin of the struck nucleon in the nucleus. Conclusions: In our calculations we contrast elastic scattering off closed-shell and open-shell nuclei. We find that for closed-shell nuclei the approximation of ignoring the spin of the struck target nucleon is excellent. We only see effects of the spin of the struck target nucleon when considering $^6$He and $^8$He, which are nuclei with a $N/Z$ ratio larger than 1.

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Spin dependent ab initio nonlocal No-Core Shell-Model One-Body Densities

Constructing microscopic effective interactions (`optical potentials') for nucleon-nucleus (NA) elastic scattering requires in first order off-shell nucleon-nucleon (NN) scattering amplitudes between the projectile and the struck target nucleon and nonlocal one-body density matrices. While the NN amplitudes and the {\it ab intio} no-core shell-model (NCSM) calculations always contain the full spin structure of the NN problem, one-body density matrices used in traditional microscopic folding potential neglect spin contributions inherent in the one-body density matrix. Here we derive and show the expectation values of the spin-orbit contribution of the struck nucleon with respect to the rest of the nucleus for $^{4}$He, $^{6}$He, $^{12}$C, and $^{16}$O and compare them with the scalar one-body density matrix.

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Deuteron-alpha scattering: separable vs nonseparable Faddeev approach

{\bf Background} Deuteron induced reactions are widely used to probe nuclear structure and astrophysical information. Those (d,p) reactions may be viewed as three-body reactions and described with Faddeev techniques. {\bf Purpose} Faddeev-AGS equations in momentum space have a long tradition of utilizing separable interactions in order to arrive at sets of coupled integral equations in one variable. However, it needs to be demonstrated that observables calculated based on separable interactions agree exactly with those based on nonseparable forces. {\bf Methods} Momentum space AGS equations are solved with separable and nonseparable forces as coupled integral equations. {\bf Results} Deuteron-alpha scattering is calculated via momentum space AGS equations using the CD-Bonn neutron-proton force and a Woods-Saxon type neutron(proton)-$^4$He force, for which the Pauli-forbidden S-wave bound state is projected out. Elastic as well as breakup observables are calculated and compared to results in which the interactions in the two-body sub-systems are represented by separable interactions derived in the Ernst-Shakin-Thaler (EST) framework. {\bf Conclusions} We find that the calculations based on the separable representation of the interactions and the original interactions give results that are in excellent agreement. Specifically, integrated cross sections and angular distributions for elastic scattering agree within $\approx$ 1\%, which is well below typical experimental errors. In addition, the five-fold differential cross sections corresponding to breakup of the deuteron agree extremely well.

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Ab initio Folding Potentials for Nucleon-Nucleus Scattering based on NCSM One-Body Densities

Calculating microscopic optical potentials for elastic nucleon-nucleus scattering has already led to large body of work in the past. For folding first-order calculations the nucleon-nucleon (NN) interaction and the one-body density of the nucleus were taken as input to rigorous calculations in a spectator expansion of the multiple scattering series. Based on the Watson expansion of the multiple scattering series we employ a nonlocal translationally invariant nuclear density derived from a chiral next-to-next-to-leading order (NNLO) and the very same interaction for consistent full-folding calculation of the effective (optical) potential for nucleon-nucleus scattering for light nuclei. We calculate scattering observables, such as total, reaction, and differential cross sections as well as the analyzing power and the spin-rotation parameter, for elastic scattering of protons and neutrons from $^4$He, $^{6}$He, $^{12}$C, and $^{16}$O, in the energy regime between 100 and 200~MeV projectile kinetic energy, and compare to available data. Our calculations show that the effective nucleon-nucleus potential obtained from the first-order term in the spectator expansion of the multiple scattering expansion describes experiments very well to about 60 degrees in the center-of-mass frame, which coincides roughly with the validity of the NNLO chiral interaction used to calculate both the NN amplitudes and the one-body nuclear density.

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Few-body universality in the deuteron-alpha system

We treat ${}^6$Li as an effective three-body ($n$-$p$-$α$) system and compute the $d$-$α$ $S-$wave scattering length and three-body separation energy of ${}^6$Li for a wide variety of nucleon-nucleon and $α$-nucleon potentials which have the same (or nearly the same) phase shifts. The Coulomb interaction in the $p$-$α$ subsystem is omitted. The results of all calculations lie on a one-parameter curve in the plane defined by the $d$-$α$ $S-$wave scattering length and the amount by which ${}^6$Li is bound with respect to the $n$-$p$-$α$ threshold. We argue that these aspects of the $n$-$p$-$α$ system can be understood using few-body universality and that ${}^6$Li can thus usefully be thought of as a two-nucleon halo nucleus.

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