Related papers: All-order relativistic computations for atoms and …
We have constructed a perturbation theory to treat interactions that can include the Coulomb interaction, describing a physical problem that is often encountered in nuclear physics. The Coulomb part is not treated perturbatively; the exact…
An efficient solution of the Dirac Hamiltonian flow equations has been proposed through a novel expandsion with the inverse of the Dirac effective mass. The efficiency and accuracy of this new expansion have been demonstrated by reducing a…
Numerical projection methods are elaborated for the calculation of eigenstates of the non-relativistic many-particle Coulomb Hamiltonian with selected rotational and parity quantum numbers employing shifted explicitly correlated Gaussian…
Although the post-Newtonian Lagrangian formalism is widely used in relativistic dynamical and statistical studies of test bodies moving around arbitrary mass distributions, the corresponding general Hamiltonian formalism is still relatively…
Slater determinants have underpinned quantum chemistry for nearly a century, yet their full potential has remained challenging to exploit. In this work, we show that a variational wavefunction composed of a few hundred optimized…
Using the nonrelativistic approximation in the curved-space Dirac equation, the analog of the Pauli equation is derived for a weak gravitational field with a gauge fixing condition related to the synchronous gauge, in the presence of an…
The "catastrophe" in solving the Dirac equation for an electron in the field of a point electric charge, which emerges for the charge numbers Z > 137, is removed in this work by effective accounting of finite dimensions of nuclei. For this…
Perturbation theory is used systematically to investigate the symmetries of the Dirac Hamiltonian and their breaking in atomic nuclei. Using the perturbation corrections to the single-particle energies and wave functions, the link between…
We present electric dipole polarizabilities ($\alpha_d$) of the alkali-metal negative ions, from H$^-$ to Fr$^-$, by employing four-component relativistic many-body methods. Differences in the results are shown by considering Dirac-Coulomb…
Seeking for a relativistic generalisation of the non-relativistic Schroedinger equation, one very soon arrives at equations with a square-root operator by having applied the quantum mechanical correspondence principle to the formula of…
The quantum mechanical motion of the atomic nuclei is considered over a single- or a multi-dimensional subspace of electronic states which is separated by a gap from the rest of the electronic spectrum over the relevant range of nuclear…
A saturating hamiltonian is presented in a relativistically covariant formalism. The interaction is described by scalar and vector mesons, with coupling strengths adjusted to the nuclear matter. No explicit density depe ndence is assumed.…
The Hamiltonian approach to the General Relativity is formulated as a joint nonlinear realization of conformal and affine symmetries by means of the Dirac scalar dilaton and the Maurer-Cartan forms. The dominance of the Casimir vacuum…
High-resolution simulations of particle-based kinetic plasma models typically require a high number of particles and thus often become computationally intractable. This is exacerbated in multi-query simulations, where the problem depends on…
A simple scheme is described for introducing the correct cusps at nuclei into orbitals obtained from Gaussian basis set electronic structure calculations. The scheme is tested with all-electron variational quantum Monte Carlo (VMC) and…
Complete vacuum polarization calculations incorporating finite nuclear size are presented for hydrogenic ions with principal quantum numbers n=1-5. Lithiumlike, sodiumlike, and copperlike ions are also treated starting with Kohn-Sham…
The Dirac Hamiltonian $H^{\left(D\right)}$ for relativistic charged fermions minimally coupled to (possibly time-dependent) electromagnetic fields is transformed with a purpose-built flow equation method, so that the result of that…
Stimulated by the proton radius conundrum, measurements of the Lamb shift in various light muonic atoms are planned at PSI. The aim is to extract the rms charge radius with high precision, limited by the uncertainty in the nuclear…
Ab initio computations of atomic nuclei, based on Hamiltonians from effective field theories of quantum chromodynamics, are now routinely used to predict and describe properties of medium heavy nuclei, and even the heavy nucleus $^{208}$Pb…
We present an improved calculation of higher-order corrections to the one-loop self energy of 2P states in hydrogen-like systems with small nuclear charge Z. The method is based on a division of the integration with respect to the photon…