We study the use of truncated normal-ordered three-nucleon interactions in nuclear structure calculations starting from chiral two- plus three-nucleon Hamiltonians evolved consistently with the similarity renormalization group. We present three key developments: (i) a rigorous benchmark of the normal-ordering approximation in the importance-truncated no-core shell model for (4)He, (16)O, and (40)Ca; (ii) a direct comparison of the importance-truncated no-core shell model results with coupled-cluster calculations at the singles and doubles level for (16)O; and (iii) first applications of similarity renormalization group-evolved chiral NN+3N Hamiltonians in coupled-cluster calculations for medium-mass nuclei (16,24)O and (40,48)Ca. We show that the normal-ordered two-body approximation works very well beyond the lightest isotopes and opens a path for studies of medium-mass and heavy nuclei with chiral two- plus three-nucleon interactions. At the same time we highlight the predictive power of chiral Hamiltonians.

We present calculations of nucleon-deuteron scattering as well as ground and low-lying excited states of light nuclei in the mass range A=3-16 up through next-to-next-to-leading order in chiral effective field theory using semilocal coordinate-space regularized two-and three-nucleon forces. It is shown that both of the low-energy constants entering the three-nucleon force at this order can be determined from the triton binding energy and the differential cross section minimum in elastic nucleon-deuteron scattering. From all considered nucleon-deuteron scattering observables, the strongest constraint on these low-energy constants emerges from the precisely measured cross section minimum at EN = 70 MeV. The inclusion of the three-nucleon force is found to improve the agreement with the data for most of the considered observables.

We merge two successful ab initio nuclear-structure methods, the no-core shell model (NCSM) and the multireference in-medium similarity renormalization group (IM-SRG) to define a new many-body approach for the comprehensive description of ground and excited states of closed and open-shell nuclei. Building on the key advantages of the two methods-the decoupling of excitations at the many-body level in the IM-SRG and the access to arbitrary nuclei, eigenstates, and observables in the NCSM-their combination enables fully converged no-core calculations for an unprecedented range of nuclei and observables at moderate computational cost. We present applications in the carbon and oxygen isotopic chains, where conventional NCSM calculations are still feasible and provide an important benchmark. The efficiency and rapid convergence of the new approach make it ideally suited for ab initio studies of the complete spectroscopy of nuclei up into the medium-mass regime.

We introduce a hybrid many-body approach that combines the flexibility of the No-Core Shell Model (NCSM) with the efficiency of Multi-Configurational Perturbation Theory (MCPT) to compute ground-and excited-state energies in arbitrary open-shell nuclei in large model spaces. The NCSM in small model spaces is used to define a multi-determinantal reference state that contains the most important multi-particle multi-hole correlations and a subsequent second-order MCPT correction is used to capture additional correlation effects from a large model space. We apply this new ab initio approach for the calculation of ground-state and excitation energies of even and odd-mass carbon, oxygen, and fluorine isotopes and compare to large-scale NCSM calculations that are computationally much more expensive.

We employ a variety of ab initio methods including Faddeev-Yakubovsky equations, No-Core Configuration Interaction Approach, Coupled-Cluster Theory and In-Medium Similarity Renormalization Group to perform a comprehensive analysis of the nucleon-deuteron elastic and breakup reactions and selected properties of light and medium-mass nuclei up to 48 Ca using the recently constructed semilocal coordinate-space regularized chiral nucleon-nucleon potentials. We compare the results with those based on selected phenomenological and chiral EFT two-nucleon potentials, discuss the convergence pattern of the chiral expansion and estimate the achievable theoretical accuracy at various chiral orders using the novel approach to quantify truncation errors of the chiral expansion without relying on cutoff variation. We also address the robustness of this method and explore alternative ways to estimate the theoretical uncertainty from the truncation of the chiral expansion.