Effective Two-body Interaction Research Articles

Analyzing the Nuclear Structure of 13O-13B and 13N-13C Mirror Nuclei

In the context of the shell model, electromagnetic transitions were used to analyze the nuclear structure of a mirror nucleus with the same mass number, A = 13. The shell model investigation was performed by calculating the root mean square (rms) for the proton, neutron, matter and charge radii, occupancies, the excitation energies, as well as electromagnetic moments, using the elements of a body density matrix of the PSDMOD two-body effective interactions carried out in the psdpn-shell model space. The present results adopted the harmonic oscillator's single particle eigen functions and Hartree-Fock approximation. In addition, the effect of core polarization was added using the effective charge and effective g factors to calculate electromagnetic moments. To acquire a fair analysis of the information, the core polarization has to be present. The outcomes were compared with experimental data

Theory of Majorana-Type Heavy Ion Double Charge Exchange Reactions by Pion–Nucleon Isotensor Interactions

The theory of heavy ion double charge exchange (DCE) reactions proceeding by effective rank-2 isotensor interactions is presented. Virtual pion–nucleon charge exchange interactions are investigated as the source for induced isotensor interactions, giving rise to the Majorana DCE (MDCE) reaction mechanism. MDCE is of a generic character, proceeding through pairs of complementary (π±,π∓) reactions in the projectile and target nucleus. The dynamics of the elementary processes is discussed, where the excitation of pion–nucleon resonances are of central importance. Investigations of initial and final state ion–ion interactions show that these effects are acting as vertex renormalizations. In closure approximation, well justified by the finite pion mass, the second-order transition matrix elements reduce to pion potentials and effective two-body isotensor DCE interactions, giving rise also to two-body correlations in either of the participating nuclei. Connections to neutrinoless Majorana double beta decay (MDBD) are elucidated at various levels of the dynamics, from the underlying fundamental electro-weak and QCD scales to the physical scales of nuclear MDBD and MDCE physics. It is pointed out that heavy ion MDCE reactions may also proceed by competing electro-weak charge exchange processes, leading to lepton MDCE by electrons, positrons, and neutrinos.

Position of the single-particle 3/2− state in 135Sn and the N=90 subshell closure

The decay of excited states of the nucleus 135Sn, with three neutrons outside the doubly-magic 132Sn core, was studied in an experiment performed at the Radioactive Isotope Beam Factory at RIKEN. Several γ rays emitted from excited 135Sn ions were observed following one-neutron and one-neutron-one-proton removal from 136Sn and 137Sb beams, respectively, on a beryllium target at relativistic energies. Based on the analogy to 133Sn populated via one-neutron removal from 134Sn, an excitation energy of 695(15) keV is assigned to the 3/2− state with strongest single-particle character in 135Sn. This result provides the first direct information about the evolution of the neutron shell structure beyond N=82 and thus allows for a crucial test of shell-model calculations in this region. The experimental findings are in full agreement with calculations performed employing microscopic effective two-body interactions derived from CD-Bonn and N3LO nucleon-nucleon potentials, which do not predict a pronounced subshell gap at neutron number N=90. The occurrence of such a gap in 140Sn, i.e., when the 1f7/2 orbital is completely filled, had been proposed in the past, in analogy to the magicity of 48Ca, featuring a completely filled 0f7/2 orbital one harmonic oscillator shell below.

Behavior of the continuum coupling correlation energy in the vicinity of the particle emission threshold - Gamow shell model study

The Gamow shell model provides the open quantum system formulation of nuclear shell model. In the coupled-channel representation, Gamow shell model provides the unified theory of nuclear structure and reactions which is well suited for the study of resonances and clustering. In this work, we apply this approach to study the continuum-coupling correlation energy for selected near-threshold states of 7Li, 7Be, using a translationally invariant Hamiltonian with an effective finite-range two-body interaction.

Magic Numbers and Stabilities of Photoionized Water Clusters: Computational and Experimental Characterization of the Nanosolvated Hydronium Ion.

The stability and distributions of small water clusters generated in a supersonic beam expansion are interrogated by tunable vacuum ultraviolet (VUV) radiation generated at a synchrotron. Time-of-flight mass spectrometry reveals enhanced population of various protonated water clusters (H+(H2O)n) based upon ionization energy and photoionization distance from source, suggesting there are "magic" numbers below the traditional n = 21 that predominates in the literature. These intensity distributions suggest that VUV threshold photoionization (11.0-11.5 eV) of neutral water clusters close to the nozzle exit leads to a different nonequilibrium state compared to a skimmed molecular beam. This results in the appearance of a new magic number at 14. Metadynamics conformer searches coupled with modern density functional calculations are used to identify the global minimum energy structures of protonated water clusters between n = 2 and 21, as well as the manifold of low-lying metastable minima. New lowest energy structures are reported for the cases of n = 5, 6, 11, 12, 16, and 18, and special stability is identified by several measures. These theoretical results are in agreement with the experiments performed in this work in that n = 14 is shown to exhibit additional stability, based on the computed second-order stabilization energy relative to most cluster sizes, though not to the extent of the well-known n = 21 cluster. Other cluster sizes that show some additional energetic stability are n = 7, 9, 12, 17, and 19. To gain insight into the balance between ion-water and water-water interactions as a function of the cluster size, an analysis of the effective two-body interactions (which sum exactly to the total interaction energy) was performed. This analysis reveals a crossover as a function of cluster size between a water-hydronium-dominated regime for small clusters and a water-water-dominated regime for larger clusters around n = 17.

Fast and accurate prediction of material properties with three-body tight-binding model for the periodic table.

Parametrized tight-binding models fit to first-principles calculations can provide an efficient and accurate quantum mechanical method for predicting properties of molecules and solids. However, well-tested parameter sets are generally only available for a limited number of atom combinations, making routine use of this method difficult. Furthermore, many previous models consider only simple two-body interactions, which limits accuracy. To tackle these challenges, we develop a density functional theory database of nearly 1 000 000 materials, which we use to fit a universal set of tight-binding parameters for 65 elements and their binary combinations. We include both two-body and three-body effective interaction terms in our model, plus self-consistent charge transfer, enabling our model to work for metallic, covalent, and ionic bonds with the same parameter set. To ensure predictive power, we adopt a learning framework where we repeatedly test the model on new low-energy crystal structures and then add them to the fitting data set, iterating until predictions improve. We distribute the materials database and tools developed in this paper publicly.

Hamiltonian sensitivity in calculating the electromagnetic moments and electroexcitation form factor for the sd nuclei using shell model with Skyrme–Hartree–Fock

In this work, the nuclear electromagnetic moments for the ground and low-lying excited states for sd shell nuclei have been calculated, resulting in a revised database with 56 magnetic dipole moments and 41 electric quadrupole moments. The shell model calculations are performed for each sd isotope chain, considering the sensitivity of changing the sd two-body effective interactions USDA, USDE, CWH and HBMUSD in the calculation of the one-body transition density matrix elements. The calculations incorporate the single-particle wave functions of the Skyrme interaction to generate a one-body potential in Hartree–Fock theory to calculate the single-particle matrix elements. For most sd shell nuclei, the experimental data are well reproduced, except for those spans near the island of inversion. In order to interpret the structure of low-lying excited states, the electric quadrupole and magnetic dipole transition form factors and the corresponding reduced transition probabilities in the sd shell nuclei have also been calculated, for which the experimental data are available. The present results demonstrate the nuclear electromagnetic moments’ sensitivity to many forms of the understanding of nucleon–nucleon interactions and provide a crucial baseline for future improvements in conceptual calculations.

Calculation of the electromagnetic moments and electroexcitation form factors for some boron isotopes using shell model with skyrme interaction

The magnetic dipole and electric quadrupole moments for some Boron isotopes were calculated using the shell model taking into account the effect of the two-body effective interactions and the single-particle potentials. These isotopes are; (8 5)B(2 +), (1 50)B(3 +), (1 51)B((3/2)−), ( 1 52)B(1 +) and (1 53)B((3/2)−). Also, the elastic and inelastic longitudinal and transverse electron scattering form factors are calculated for 10B and 11B, for which there are available experimental data. The one-body transition density matrix elements (OBDM) were calculated using the two-body effective interactions; PWT, PEWT, PKUO and CKIHE, which are carried out in the p-shell model space. Skyrme interaction was implemented to generate the single-particle matrix elements with Hartree-Fock approximation and compared with those of harmonic-oscillator and Wood-Saxon potentials. All the evaluated results were compared with available experimental data. The present work has led us to conclude that the shell model calculations with Skyrme type interaction give a good tool for nuclear structure studies. All signs for the experimental electromagnetic moments data are reproduced correctly. The longitudinal and transverse form factors for positive and negative parity states are fairly well reproduced when using a suitable model space.

Excitation spectrum of tunable spin-orbit coupled Bose-Einstein condensates and its effective regulation

<sec>In a recent experiment, the excitation spectrum of spin-orbit (SO) coupled Bose-Einstein condensates (BECs) of <inline-formula><tex-math id="M1">\begin{document}$^{87}{\rm{Rb}}$\end{document}</tex-math><alternatives><graphic xmlns:xlink="http://www.w3.org/1999/xlink" xlink:href="6-20222306_M1.jpg"/><graphic xmlns:xlink="http://www.w3.org/1999/xlink" xlink:href="6-20222306_M1.png"/></alternatives></inline-formula> atoms was studied by using Bragg spectroscopy, and the roton-maxon structure was found to exist in the excitation spectrum of magnetized phase. In addition, the roton-mode and its softening phenomenon are obtained by using various artificial SO couplings such as Rashba SO coupling and spin-orbital-angular-momentum coupling. However, the SO coupling strength in previous studies could not be controlled in real time, which limits the further study and precise regulation of the excitation spectrum of condensate. Thus, it is still an important topic to study how to regulate the SO coupling strength of the system through an external driving field, and further regulate the excitation spectrum of SO coupled BECs.</sec> <sec>In this work, the excitation spectrum of a tunable SO coupled BECs in free space is studied by using Bogoliubov theory. The time-independent effective Floquet Hamiltonian with two-body interaction is obtained in the high frequency approximation, and then a tunable SO coupling and an effective two-body interaction that can be regulated by the periodic driving of Raman coupling are obtained. Based on the effective Floquet Hamiltonian of the system, the dispersion relation of the BECs with interactions is numerically calculated. It is found that the periodic driving can effectively regulate the structure of the dispersion relation, which indicates that the periodic driving can regulate the phase transition between the zero-momentum phase and the plane wave phase. Then, the Bogoliubov-de-Gennes (BdG) equation of the system is obtained by using Bogoliubov theory. Moreover, the excitation spectrum of the BECs in the zero momentum phase and the plane wave phase are studied, respectively. Only the phonon excitation exists in the excitation spectrum of the zero momentum phase, and the excitation spectrum behaves as a Bessel function with the increase of the periodic driving strength. The phonon and roton excitations exist in the excitation spectrum of the plane wave phase, and the roton mode gradually softens with the increase of periodically driving strength. Therefore, the phonon and roton excitations in the excitation spectrum of SO coupled BECs can be regulated in real time by periodically driving Raman coupling.</sec>

Density matrix renormalization group description of the island of inversion isotopes F28–33

Recent experiments have confirmed that the neutron-rich isotopes $^{28,29}$F belong to the so-called island of inversion (IOI), a region of the nuclear chart around $Z=10$ and $N=20$ where nuclear structure deviates from the standard shell model predictions due to deformation and continuum effects. However, while the general principles leading to the IOI are relatively well understood, the details of the low-lying structure of the exotic fluorine isotopes $^{28-33}$F are basically unknown. In this work, we perform large-scale shell model calculations including continuum states to investigate the properties of the neutron-rich isotopes $^{25-33}$F, using a core of $^{24}$O and an effective two-body interaction with only three adjustable parameters. We adjust the core potential and interaction on experimentally confirmed states in $^{25,26}$O and $^{25-27}$F and solve the many-body problem using the density matrix renormalization group method for open quantum systems in a $sd$-$fp$ model space. We obtain the first detailed spectroscopy of $^{25-33}$F in the continuum and show how the interplay between continuum effects and deformation explains the recent data on $^{28,29}$F, and produces an inversion of the ${5/2}^+$ and ${1/2}^+$ states in $^{29,31,33}$F. Several deformed one- and two-neutron halo states are predicted in $^{29,31}$F, and we predict the ground state of $^{30}$F to have a structure similar to that of the first ${5/2}^+$ state of $^{29}$F. We also suggest several experimental studies to constraint models and test the present predictions. The complex structure of neutron-rich fluorine isotopes offers a trove of information about the formation of the southern shore of the IOI through a subtle interplay of deformation and continuum couplings driven by the occupation of the quasi-degenerate neutron shells $0d_{3/2}$ and $1p_{3/2}$.

Calculation of the Magnetic Dipole and Electric Quadrupole Moments of some Sodium Isotopes using Shell Model with Skyrme Interaction

In the present work, the magnetic dipole and electric quadrupole moments for some sodium isotopes have been calculated using the shell model, considering the effect of the two-body effective interactions and the single-particle potentials. These isotopes are; 21Na (3/2+), 23Na (3/2+), 25Na (5/2+), 26Na (3+), 27Na (5/2+), 28Na (1+) and, 29Na (3/2+). The one-body transition density matrix elements (OBDM) have been calculated using the (USDA, USDB, HBUMSD and W) two-body effective interactions carried out in the sd-shell model space. The sd shell model space consists of the active 2s1/2, 1d5/2, and1d1/2 valence orbits above the inert 16O nucleus core, which remains closed. Skyrme interaction was implemented to generate the single-particle matrix elements with Hartree-Fock approximation and compared with those of harmonic oscillator and Wood-Saxon potentials. From the outcome of our investigation, it is possible to conclude that the shell model calculations with Skyrme-type interaction give a reasonable description for most of the selected Na isotopes. No significant difference was noticed for the magnetic dipole moments and electric quadrupole moments with experimental data, where all signs for the experimental data are reproduced correctly.

A new effective potential for deuteron

We calculate for the first time the static properties of the deuteron, within the framework of supersymmetric quantum mechanics, analytically. A new effective potential and its partner are derived from a superpotential so that all parameters are fitted by the experimental data. An analytical expression is obtained for the deuteron wave function and contributions of the orthogonal 13 S 1 and 13 D 1 states are determined, explicitly. Compared to one pion exchange, the superpotential produces an electrostatic as well as two pion exchange terms for the potential. The saddle point radius of the potential and the maximum of the wave function are linearly proportional. In comparison with other methods, the approach presented in this paper is a new and extensible symmetry-based approach that, despite its straightforward calculations and explicit analytical expressions, provides a good explanation for two-body effective interactions such as two-nucleon systems and diatomic molecules.

Shell Model Description of Spin-Dependent Elastic and Inelastic WIMP Scattering off 119Sn and 121Sb

In this work, we calculate the spin structure functions for spin-dependent elastic and inelastic WIMP scattering off 119Sn and 121Sb. Estimates for detection rates are also given. 119Sn and 121Sb are amenable to nuclear structure calculations using the nuclear shell model (NSM). With the possible exception of 201Hg, they are the only such nuclei still unexplored theoretically for their potential of inelastic WIMP scattering to a very low excited state. The present calculations were conducted using a state-of-the-art WIMP–nucleus scattering formalism, and the available effective NSM two-body interactions describe the spectroscopic properties of these nuclei reasonably well. Structure functions were found to be high for both nuclei in the case of elastic scattering. Elastic scattering dominated at the zero momentum transfer limit. Detection rate calculations indicated that inelastic scattering was relevant for both nuclei, even surpassing elastic rates for some recoil energies.

Axially-deformed solution of the Skyrme-Hartree-Fock-Bogoliubov equations using the transformed harmonic oscillator basis (IV) hfbtho (v4.0): A new version of the program

We describe the new version 4.0 of the code hfbtho that solves the nuclear Hartree-Fock-Bogoliubov problem by using the deformed harmonic oscillator basis in cylindrical coordinates. In the new version, we have implemented the restoration of rotational, particle number, and reflection symmetry for even-even nuclei. The restoration of rotational symmetry does not require using bases closed under rotation. Furthermore, we added the SeaLL1 functional and improved the calculation of the Coulomb potential. Finally, we refactored the code to facilitate maintenance and future developments. New version program summaryProgram title:hfbtho v4.0CPC Library link to program files:https://doi.org/10.17632/c5g2f92by3.2Code Ocean capsule:https://codeocean.com/capsule/5389629Licensing provisions: GPLv3Programming language: Fortran 2003Journal reference of previous version: R.N. Pérez, N. Schunck, R.-D. Lasseri, C. Zhang and J. Sarich, Comput. Phys. Commun. 220 (2017) 363Does the new version supersede the previous version: YesReasons for the new version: This version adds new capabilities to restore broken symmetries and determine corresponding quantum numbers of even-even nucleiSummary of revisions:1.Angular momentum projection for even-even nuclei in a deformed basis;2.Particle number projection for even-even nuclei in the quasiparticle basis;3.Implementation of the SeaLL1 functional;4.Expansion of the Coulomb potential onto Gaussians;5.MPI-parallelization of a single hfbtho execution;6.Code refactoring.Nature of problem:hfbtho is a physics computer code that is used to model the structure of the nucleus. It is an implementation of the energy density functional (EDF) approach to atomic nuclei, where the energy of the nucleus is obtained by integration over space of some phenomenological energy density, which is itself a functional of the neutron and proton intrinsic densities. In the present version of hfbtho, the energy density is derived either from the zero-range Skyrme or the finite-range Gogny effective two-body interaction between nucleons. Nuclear superfluidity is treated at the Hartree-Fock-Bogoliubov (HFB) approximation. Constraints on the nuclear shape allow probing the potential energy surface of the nucleus as needed, e.g., for the description of shape isomers or fission. A local scale transformation of the single-particle basis in which the HFB solutions are expanded provides a tool to properly compute the structure of weakly-bound nuclei. Restoration of the rotational, particle number, and reflection symmetry for even-even nuclei enables recovering the quantum numbers that are lost at the HFB approximation.Solution method: The program uses the axial harmonic oscillator (HO) or the transformed harmonic oscillator (THO) single-particle basis to expand quasiparticle wave functions. It iteratively diagonalizes the HFB Hamiltonian based on generalized Skyrme-like energy densities and zero-range pairing interactions or the finite-range Gogny force until a self-consistent solution is found. Lagrange parameters are used to impose constraints on HFB solutions, and their value is updated at each iteration from an approximation of the quasiparticle random phase approximation (QRPA) matrix. Symmetry restoration is implemented through standard projection techniques. Previous versions of the program were presented in [1-3].Additional comments including restrictions and unusual features: Axial and time-reversal symmetries are assumed in HFB calculations; y-simplex symmetry and even particle numbers are assumed in angular momentum projection.

Coulomb C2 and C4 Form Factors of 18O, 20,22Ne Nuclei Using Bohr−Mottelson Collective Model

Coulomb C2 and C4 form factors with core-polarization effects to 2+ and 4+ states in 18O and 20,22Ne have been studied using shell model calculations. The two-body effective Wildenthal interaction and universal sd-shell interaction A (USDA) are used for sd-shell orbits. Corepolarization effects are calculated using the Coulomb valance Tassie model (CVTM) and Bohr–Mottelson (BM) collective model. Some wave functions of the radial single-particle matrix elements have been calculated with harmonic oscillator (HO), Wood–Saxon (WS), and SKX potentials. The inclusions of core-polarization effects give good agreements with experimental data as comparing with model space calculations. The results for different potentials are compared.

Enhancing the Accuracy of Ab Initio Molecular Dynamics by Fine Tuning of Effective Two-Body Interactions: Acetonitrile as a Test Case.

Grimme's dispersion-corrected density functional theory (DFT-D) methods have emerged among the most practical approaches to perform accurate quantum mechanical calculations on molecular systems ranging from small clusters to microscopic and mesoscopic samples, i.e., including hundreds or thousands of molecules. Moreover, DFT-D functionals can be easily integrated into popular ab initio molecular dynamics (MD) software packages to carry out first-principles condensed-phase simulations at an affordable computational cost. Here, starting from the well-established D3 version of the dispersion-correction term, we present a simple protocol to improve the accurate description of the intermolecular interactions of molecular clusters of growing size, considering acetonitrile as a test case. Optimization of the interaction energy was performed with reference to diffusion quantum Monte Carlo calculations, successfully reaching the same inherent accuracy of the latter (statistical error of ∼0.1 kcal/mol per molecule). The refined DFT-D3 model was then used to perform ab initio MD simulations of liquid acetonitrile, again showing significant improvements toward available experimental data with respect to the default correction.

Shell evolution for neutron-rich 46–54Ar isotopes in the full and truncated fp neutron model spaces

The shell evolution of even–even drip line argon isotopes [Formula: see text] has been investigated via the shell model calculations using SDPF-U and SDPF-NR two-body effective interactions in two different shell model spaces [Formula: see text] and [Formula: see text]. In this work, the energy of first [Formula: see text], reduced transition probability [Formula: see text], excitation energy levels as well as how the proton shells evolve with [Formula: see text] have been studied. Excellent agreements were obtained for the first [Formula: see text] level along the investigated isotopes within [Formula: see text] and [Formula: see text] model spaces.

Statistical Interactions and Boson-Anyon Duality in Fractional Quantum Hall Fluids.

We present an exact scheme of bosonization for anyons (including fermions) in the two-dimensional manifold of the quantum Hall fluid. This gives every fractional quantum Hall phase of the electrons one or more dual bosonic descriptions. For interacting electrons, the statistical transmutation from anyons to bosons allows us to explicitly derive the microscopic statistical interaction between the anyons, in the form of the effective two-body and few-body interactions. This also leads to a number of unexpected topological phases of the single component bosonic fractional quantum Hall effect that may be experimentally accessible. Numerical analysis of the energy spectrum and ground state entanglement properties are carried out for simple examples.

Effective Two-Body Interactions.

Cooperative or nonadditive effects contribute to the pairwise noncovalent interaction of two molecules in a cluster or the condensed phase in ways that depend on the specific arrangements and interactions of the other surrounding molecules that constitute their environment. General expressions for an effective two-body interaction are presented, which are correct to increasing orders in the many-body expansion. The simplest result, correct through third order, requires only seven individual calculations, in contrast to a linear number of three-body contributions. Two applications are presented. First, an error analysis is performed on a model (H2O)8 cluster which completes the first solvation shell of a central water-water hydrogen bond. Energy decomposition analysis is performed to show that the largest effects of cooperativity on the central hydrogen bond arise from electrical polarization. Second, the nature of cooperative effects on proton transfer in an HCl + (H2O)4 cluster is characterized.

Three-body spin mixing in spin-1 Bose-Einstein condensates

We study zero-energy collisions between three identical bosons with spin $f = 1$ interacting via pairwise potentials. We quantify the corresponding three-body scattering hypervolumes, which parametrize the effective three-body interaction strengths in a many-body description of spin-1 Bose-Einstein condensates. Our results demonstrate universal behavior of the scattering hypervolumes for strong $s$- and $p$-wave two-body interactions. At weak interactions we find that the real parts of the scattering hypervolumes are predominantly determined by hard-hyperspherelike collisions which we characterize by a simple formula. With this universal result we estimate that spin mixing via three-body collisions starts to dominate over two-body spin mixing at a typical particle density of $10^{17}~\mathrm{cm}^{-3}$ for ${}^{23}$Na and ${}^{41}$K spinor condensates. This density can be reduced by tuning the two-body interactions to an $s$- or $p$-wave dimer resonance or to a point where two-body spin mixing effectively vanishes. Another possibility to observe effects of three-body spin mixing involves the application of weak magnetic fields to cancel out the effective two-body interaction strength in the characteristic timescale describing the spin dynamics.