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Register a new userCoupled-cluster calculations for valence systems around O-16
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J.R. Gour
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We study the ground and low-lying excited states of O-15, O-17, N-15, and F-17 using modern two-body nucleon-nucleon interactions and the suitably designed variants of the ab initio equation-of-motion coupled-cluster theory aimed at an accurate description of systems with valence particles and holes. A number of properties of O-15, O-17, N-15, and F-17, including ways the energies of ground and excited states of valence systems around O-16 change as functions of the number of nucleons, are correctly reproduced by the equation-of-motion coupled-cluster calculations. Within a harmonic oscillator basis and large effective model spaces, our results are converged for the chosen two-body Hamiltonians. Thus, all disagreements with experiment are, most likely, due to the degrees of freedom such as three-body interactions not accounted for in our effective two-body Hamiltonians. In particular, the calculated binding energies of O-15/N-15 and O-17/F-17 enable us to rationalize the discrepancy between the experimental and recently published [Phys. Rev. Lett. 94, 212501 (2005)] equation-of-motion coupled-cluster excitation energies for the Jpi=3- state of O-16. The results demonstrate the feasibility of the equation-of-motion coupled-cluster methods to deal with valence systems around closed-shell nuclei and to provide precise results for systems beyond A=16.
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Using the ground-state energy of 16-O obtained with the realistic V_UCOM interaction as a test case, we present a comprehensive comparison of different configuration interaction (CI) and coupled-cluster (CC) methods, analyzing the intrinsic advantages and limitations of each of the approaches. In particular, we use the importance-truncated (IT) CI and no-core shell model (NCSM) schemes with up to 4-particle-4-hole (4p4h) excitations as well as the size extensive CC methods with a complete treatment of one- and two-body clusters (CCSD) and a non-iterative treatment of connected three-body clusters via the completely renormalized correction to the CCSD energy defining the CR-CC(2,3) approach. We discuss the impact of the center-of-mass contaminations, the choice of the single-particle basis, and size-extensivity on the resulting energies. When the IT-CI and IT-NCSM methods include the 4p4h excitations and when the CC calculations include the 1p1h, 2p2h, and 3p3h clusters, as in the CR-CC(2,3) approach, we observe an excellent agreement among the different methodologies. This shows that despite their individual limitations, the IT-CI, IT-NCSM, and CC methods can provide precise and consistent ab initio nuclear structure predictions. Furthermore, the IT-CI, IT-NCSM, and CC ground-state energy values obtained with 16-O are in good agreement with the experimental value, proving that the V_UCOM two-body interaction allows for a realistic description of binding energies for heavier nuclei and that all of the methods used in this study account for most of the relevant particle correlation effects.
We report converged results for the ground and excited states and matter density of 16-O using realistic two-body nucleon-nucleon interactions and coupled-cluster methods and formalism developed in quantum chemistry. Most of the binding is obtained with the coupled-cluster singles and doubles approach. Additional binding due to three-body clusters (triples) is minimal. The coupled-cluster method with singles and doubles provides a good description of the matter density, charge radius, charge form factor, and excited states of a 1-particle-1-hole nature, but it cannot describe the first excited 0+ state. Incorporation of triples has no effect on the latter finding.
We demonstrate the capability of coupled-cluster theory to compute the Coulomb sum rule for the $^4$He and $^{16}$O nuclei using interactions from chiral effective field theory. We perform several checks, including a few-body benchmark for $^4$He. We provide an analysis of the center-of-mass contaminations, which we are able to safely remove. We then compare with other theoretical results and experimental data available in the literature, obtaining a fair agreement. This is a first and necessary step towards initiating a program for computing neutrino-nucleus interactions from first principles and supporting the experimental long-baseline neutrino program with a state-of-the-art theory that can reach medium-mass nuclei.
We investigate the existence of weakly coupled gas-like states comprised of three $alpha$ particles around an $^{16}$O core in $^{28}$Si. We calculate the excited states in $^{28}$Si using the multi-configuration mixing method based on the $^{16}$O + 3$alpha$ cluster model. We also include the $^{16}$O + $^{12}$C and $^{24}$Mg + $alpha$ basis wave functions prepared by the generator coordinate method. To identify the gas-like states, we calculate the isoscalar monopole transition strengths and the overlap of the obtained states with the geometrical cluster wave function and the Tohsaki-Horiuchi-Schuck-R{o}pke (THSR) wave function. The results show that the obtained fourth and twelfth states significantly overlap with the THSR wave function. These two states clearly coexist with the $^{16}$O + $^{12}$C cluster states, emerging at similar energies. The calculated isoscalar monopole strengths between those two states are significantly large, indicating that the states are members of the excitation mode. Furthermore, the calculated root-mean-squared (RMS) radii for these states also suggest that a layer of gas-like three $alpha$ particles could exist around the surface of the $^{16}$O core, which can be described as a two-dimensional gas in the intermediate state before the Hoyle-like three $alpha$ states emerge.
We have studied gas-like states of $alpha$ clusters around an $^{16}$O core in $^{24}$Mg based on a microscopic $alpha$-cluster model. This study was performed by introducing a Monte Carlo technique for the description of the THSR (Tohsaki Horiuchi Schuck R{o}pke) wave function, and the coupling effect to other low-lying cluster states was taken into account. A large isoscalar monopole ($E0$) transition strength from the ground to the gas-like state is discussed. The gas-like state of two $alpha$ clusters in $^{24}$Mg around the $^{16}$O core appears slightly below the 2$alpha$-threshold e
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