相关论文: Relativistic and electron-correlation effects in s…
We have presented the theory, implementation, and benchmark results for the one-electronic variant of spin-free exact two-component (SFX2C1e) linear response coupled cluster (LRCCSD) theory for static and dynamic polarizabilities of atoms…
Chiral Effective Field Theory is for photon energies up to 200 MeV the tool to accurately determine the polarisabilities of the neutron from deuteron Compton scattering. A multipole analysis reveals that dispersive effects from an explicit…
We present an extensive set of theoretical results for differential, integrated, and momentum transfer cross sections for the elastic scattering of electrons by zinc, cadmium, and mercury. This study extends the application of our method of…
Electron interactions with the nuclear-spin-dependent (NSD) parity non-conserving (PNC) anapole moment are strongly enhanced within heteronuclear diatomic molecules. A novel, low-energy optical rotation experiment is being proposed with the…
Recent improvements in experimental techniques for preparing ultracold molecules that contain alkali atoms (e.g., Li, Na, and K) have been reported. Based on these advances in ultracold molecules, new searches for the electric dipole moment…
We update the predictions of the SU(2) baryon chiral perturbation theory for the dipole polarisabilities of the proton, $\{\alpha_{E1},\,\beta_{M1}\}_p=\{11.2(0.7),\,3.9(0.7)\}\times10^{-4}$fm$^3$, and obtain the corresponding predictions…
Interesting electrical polarity in nanoclusters usually requires the polarizability to exceed the value R^3 of the classical sphere of radius R. We clarify how this occurs naturally in single electron quantum systems, and relate it to the…
The dielectric properties of molecules or nanostructures are usually modified in a complex manner, when assembled into a condensed phase. We propose a first-principles method to compute polarizabilities of sub-entities of solids and…
The second-order Stark effect for a planar Dirac one-electron atom in the ground state is analyzed within the framework of the Rayleigh-Schr\"odinger perturbation theory, with the use of the Sturmian series expansion of the generalized…
We study the electron correlation effects in the calculations of isotope shifts in Na and Mg+ using the relativistic coupled-cluster method. The trends of the correlation effects are explicitly discussed and comparison of the present…
Electronic charge delocalization on the molecular backbones of ionic liquid-forming ions substantially impacts their molecular polarizabilities. Density functional theory calculations of polarizabilities and volumes of many cations and…
The diquark model is used to calculate the electromagnetic polarizabilities and charge radii of the nucleons for three different potentials. Making the scalar diquark lower in mass introduces a mixing angle $\theta $ between the $\left|…
Coupled-cluster calculations of static electronic dipole polarizabilities for 145 organic molecules are performed to create a reference data set. The molecules are composed from carbon, hydrogen, nitrogen, oxygen, fluorine, sulfur,…
The article considers the successful implementation of relativistic equation-of-motion coupled cluster method for the electron attachment problem (EA-EOMCC) at the level of single- and double- excitation approximation. The implemented…
Novel equations for the electric dipole polarizability $\alpha_{_{E1}}$ of low-lying excited states in atomic nuclei -- and the related $(-2)$ moment of the total photo-absorption cross section, $\sigma_{_{-2}}$ -- are inferred in terms of…
We have studied the correlation effects in Cs and Fr arising from the interplay of the residual Coulomb interaction to all orders and the neutral weak interaction which gives rise to the parity violating electric dipole transition to first…
In this work, we propose new field-free estimators for static field-gradient polarizabilities in finite temperature PIMC simulation. Namely, dipole--quadrupole polarizability $A$, dipole--dipole--quadrupole polarizability $B$ and…
A calculation of deuteron Compton scattering using non-relativistic diagrammatic perturbation theory is presented, with the primary motivation of investigating the feasibility of determining the neutron polarizabilities from this type of…
A theoretical description of elastic polarized muon-electron scattering is presented. Complete one-loop electroweak radiative corrections are calculated with taking into account the exact dependence on the muon mass. The effects due to some…
The exchange and correlation $E_{xc}$ of strongly correlated electrons in 2D layers of finite width are studied as a function of the density parameter $r_s$, spin-polarization $\zeta$ and the temperature $T$. We explicitly treat…