相关论文: Effective action and density functional theory
Based on a detailed symmetry analysis, we state the general rules to build up the effective low energy field theory describing a system of electrons weakly interacting with the lattice degrees of freedom. The basic elements in our…
A detailed convex analysis-based formulation of density-functional theory for periodic systems in arbitrary dimensions is presented. The electron-electron interaction is taken to be of Yukawa type, harmonising with underlying function…
We investigate the possibility of electrostatic potential saturation, which may lead to the phenomenon of effective charge saturation. The system under study is a uniformly charged infinite plane immersed in an arbitrary electrolyte made up…
Standard density functional approximations often give questionable results for odd-electron radical complexes, with the error typically attributed to self-interaction. In density corrected density functional theory (DC-DFT), certain classes…
Current-density-functional theory is used to calculate ionization energies of current-carrying atomic states. A perturbative approximation to full current-density-functional theory is implemented for the first time, and found to be…
We present a brief review of the classical density functional theory of atomic and molecular fluids. We focus on the application of the theory to the determination of the solvation properties of arbitrary molecular solutes in arbitrary…
After a brief review of the definition and properties of the quantum effective Hamiltonian action we describe its renormalization flow by a functional RG equation. This equation can be used for a non-perturbative quantization and study also…
We study the interactions of a possibly dense and/or quantum degenerate gas with driving light. Both the atoms and the electromagnetic fields are represented by quantum fields throughout the analysis. We introduce a field theory version of…
Based on a methodological analysis of the effective action approach certain conceptual foundations of quantum field theory are reconsidered to establish a quest for an equation for the effective action. Relying on the functional integral…
Based on a functional-integral formalism, a generalization of the self-energy-functional theory (SFT) is proposed which is applicable to systems of interacting electrons with disorder. Similar to the pure case without disorder, a…
Improving the accuracy and thus broadening the applicability of electronic density functional theory (DFT) is crucial to many research areas, from material science, to theoretical chemistry, biophysics and biochemistry. In the last three…
In light of upcoming observations modelling perturbations in dark energy and modified gravity models has become an important topic of research. We develop an effective action to construct the components of the perturbed dark energy momentum…
It is known for quite some time that approximate density functional (ADF) theories fail disastrously when describing the dis-sociative symmetric radical cations R2+. Considering this dissociation limit, previous work has shown that…
We compare two different approaches to investigations of many-electron systems. The first is the Hartree-Fock (HF) method and the second is the Density Functional Theory (DFT). Overview of the main features and peculiar properties of the HF…
Time-dependent (current) density functional theory for many-electron systems strongly coupled to quantized electromagnetic modes of a microcavity is proposed. It is shown that the electron-photon wave function is a unique functional of the…
A rigorous treatment of light-matter interactions typically requires an interacting quantum field theory. However, most applications of interest are handled using classical or semiclassical models, which are valid only when quantum-field…
Kohn-Sham density functional theory is the base of modern computational approaches to electronic structures. Their accuracy vitally relies on the exchange-correlation energy functional, which encapsulates electron-electron interaction…
Ensemble density functional theory extends the usual Kohn-Sham machinery to quantum state ensembles involving ground- and excited states. Recent work by the authors [Phys. Rev. Lett. 119, 243001 (2017); 123, 016401 (2019)] has shown that…
The fractional quantum Hall effect remains a captivating area in condensed matter physics, characterized by strongly correlated topological order, which manifests as fractionalized excitations and anyonic statistics. Numerical simulations,…
The effective approach is applied to the analysis of inflationary magnetogenesis. Rather than assuming a particular underlying description, all the generally covariant terms potentially appearing with four space-time derivatives in the…