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Density functional theory (DFT) is applied to atomic spectra under perturbations of superfluid liquid helium. The atomic DFT of helium is used to obtain the distribution of helium atoms around the impurity atom, and the electronic DFT is…
We test the applicability of density functional theory (DFT) to spectral perturbations taking an example of a Cs atom surrounded by superfluid helium. The atomic DFT of helium is used to obtain the distribution of helium atoms around the…
Comparing with ITER, the experimental fusion machine under constraction, the next step test fusion power plant, DEMO will be characterized by very long pulse/steady-state operation and much higher plasma volume and fusion power. The…
We propose a neural-network-based variational framework for nuclear Density Functional Theory based on the extended Thomas--Fermi (ETF) model, in which proton and neutron number densities are represented by multilayer perceptrons and…
In this work we report the results of theoretical analysis of the effect of thermal environment on the thermoelectric efficiency of molecular junctions. The environment is represented by two thermal phonon baths associated with the…
We show that interstitial hydrogen nucleii on a metallic lattice are strongly coupled to their near neighbours by the unscreened electromagnetic field mediating transitions between low-lying states. We then show that in…
Recent advances in scanning tunneling spectroscopy performed on heavy-fermion metals provide a window onto local electronic properties of composite heavy-electron quasiparticles. Here we theoretically investigate the energy and temperature…
Results of numerical simulations of fusion rate d(d,p)t, for low-energy deuteron beam, colliding with deuterated metallic matrix (Raiola et al. Phys. Lett.B 547 (2002) 193 and Eur. Phys J. A 13 (2002) 377) confirm analytical estimate given…
Density functional theory (DFT) has been used to estimate vacancy formation enthalpy (H_fv) for a few transition metals like nickel (Ni) and copper (Cu). It is shown that, for these metals, H_fv is underestimated considerably by DFT. The…
In the unknown territory of transfermium nuclei, the relativistic mean-field (RMF) theory has been applied to probe decay modes which include $\alpha$-decay, spontaneous fission (SF), and a less explored weak-decay. These decay modes are…
We present the results of a multi-methodological study aimed at investigating the interaction between graphene and Tritium during its $\beta$-decay to Helium, under different levels of loading and geometrical configurations. We combine…
Precision spectroscopy of hyperfine splitting (HFS) is a crucial tool for investigating the structure of nuclei and testing quantum electrodynamics (QED). However, accurate theoretical predictions are hindered by two-photon exchange (TPE)…
The scattering of neutrinos assuming a "secret" interaction at low energy is considered. To leading order in energy, the two-body potential is a $\delta$-potential, and it is used as a motivation to study generic short-range elastic…
Topological heavy-fermion systems in three dimensions are usually classified as topological insulators or semimetals. Here, we theoretically predict a different type of heavy-fermion system (dubbed exceptional heavy-fermion semimetal) by…
Deuteron-deuteron (DD) fusion reactions can be investigated at extremely low energies due to the relatively low Coulomb barrier that can be further reduced by the surrounding electrons in metallic targets. Recently, instead of an…
The Hubbard model is one of the primary models for understanding the essential many-body physics in condensed matter systems such as Mott insulators and cuprate high-Tc superconductors. Recent advances in atomically precise fabrication in…
We develop a model in the framework of nuclear fragmentation at thermodynamic equilibrium which can be mapped onto an Ising model with constant magnetization. We work out the thermodynamic properties of the model as well as the properties…
The underlying Fermi surface is a key concept for strongly-interacting electron models and has been introduced to generalize the usual notion of the Fermi surface to generic (superconducting or insulating) systems. By using improved…
The electronic structure of the molecular compound (TTM-TTP)I_3, which exhibits a peculiar intra-molecular charge ordering, has been studied using multi-configuration ab initio calculations. First we derive an effective Hubbard-type model…
One dimensional systems strongly enhance the quantum character of electron transport. Such systems can be realized in 5d transition metals Au, Pt and Ir, in the form of suspended monatomic chains between bulk leads. Atomic chains between…