arXiv subjects

R. Starke

Publications and source records attributed to R. Starke.

10 recordsLinked to original sources

arXiv2020

Response Theory of the Electron-Phonon Coupling

This article presents a systematic theoretical enquiry concerning the conceptual foundations and the nature of phonon-mediated electron-electron interactions. Starting from the fundamental many-body Hamiltonian, we propose a simple scheme to decouple the electrons and nuclei of a crystalline solid via effective interactions. These effective interactions, which we express in terms of linear response functions, are completely symmetric under the exchange of electrons and nuclei. Correspondingly, we derive concrete formulae for both the effective electron interaction mediated by phonons and the effective core interaction mediated by electrons. In particular, we rederive from our fundamental ansatz the well-known general expressions of the effective electron-electron interaction in terms of the elastic Green function and the phonon dispersion relation. We further show that the effective core interaction coincides in the instantaneous limit with the dynamical matrix as calculated in electronic structure theory. If combined with the Kubo formalism, our general formulae lend themselves to the calculation of effective interactions from first principles. By showing the compatibility of our approach with the functional integral formalism, this work also paves the way for the derivation of ab initio initial interactions for functional renormalization group applications.

cond-mat.mtrl-sci↗

arXiv2020

Ab initio materials physics and microscopic electrodynamics of media

We argue that the amazing progress of first-principles materials physics necessitates a revision of the Standard Approach to electrodynamics of media. We hence subject this Standard Approach to a thorough critique, which shows both its inherent conceptual problems and its practical inapplicability to modern ab initio calculations. We then go on to show that the common practice in ab initio materials physics has overcome these difficulties by taking a different, microscopic approach to electrodynamics of media, only superficially resembling the Standard Approach whose validity is restricted to the macroscopic domain. As this paradigm shift went largely unnoticed outside and partly even within the ab initio community, the present article aims at a systematic development and paradigmatic discussion of this new, microscopic first-principles approach to electrodynamics of media, for which we propose the name "Functional Approach".

cond-mat.mtrl-sci↗

arXiv2019

General form of the full electromagnetic Green function in materials physics

In this article, we present the general form of the full electromagnetic Green function which is suitable for the application in bulk materials physics. In particular, we show how the seven adjustable parameter functions of the free Green function translate into seven corresponding parameter functions of the full Green function. Furthermore, for both the fundamental response tensor and the electromagnetic Green function, we discuss the reduction of the Dyson equation on the four-dimensional Minkowski space to an equivalent, three-dimensional Cartesian Dyson equation.

physics.class-ph↗

arXiv2018

Microscopic theory of refractive index applied to metamaterials: Effective current response tensor corresponding to standard relation $n^2 = \varepsilon_{\mathrm{eff}} μ_{\mathrm{eff}}$

In this article, we first derive the wavevector- and frequency-dependent, microscopic current response tensor which corresponds to the "macroscopic" ansatz $\vec D = \varepsilon_0 \varepsilon_{\mathrm{eff}} \vec E$ and $\vec B = μ_0 μ_{\mathrm{eff}} \vec H$ with wavevector- and frequency-independent, "effective" material constants $\varepsilon_{\mathrm{eff}}$ and $μ_{\mathrm{eff}}$. We then deduce the electromagnetic and optical properties of this effective material model by employing exact, microscopic response relations. In particular, we argue that for recovering the standard relation $n^2 = \varepsilon_{\mathrm{eff}} μ_{\mathrm{eff}}$ between the refractive index and the effective material constants, it is imperative to start from the microscopic wave equation in terms of the transverse dielectric function, $\varepsilon_{\mathrm{T}}(\vec k, ω) = 0$. On the phenomenological side, our result is especially relevant for metamaterials research, which draws directly on the standard relation for the refractive index in terms of effective material constants. Since for a wide class of materials the current response tensor can be calculated from first principles and compared to the model expression derived here, this work also paves the way for a systematic search for new metamaterials.

physics.class-ph↗

arXiv2017

Why history matters: ab initio rederivation of Fresnel equations confirms microscopic theory of refractive index

We provide a systematic theoretical, experimental, and historical critique of the standard derivation of Fresnel's equations, which shows in particular that these well-established equations actually contradict the traditional, macroscopic approach to electrodynamics in media. Subsequently, we give a rederivation of Fresnel's equations which is exclusively based on the microscopic Maxwell equations and hence in accordance with modern first-principles materials physics. In particular, as a main outcome of this analysis being of a more general interest, we propose the most general boundary conditions on electric and magnetic fields which are valid on the microscopic level.

physics.optics↗

arXiv2017

Functional Approach to Electrodynamics of Media

In this article, we put forward a new approach to electrodynamics of materials. Based on the identification of induced electromagnetic fields as the microscopic counterparts of polarization and magnetization, we systematically employ the mutual functional dependencies of induced, external and total field quantities. This allows for a unified, relativistic description of the electromagnetic response without assuming the material to be composed of electric or magnetic dipoles. Using this approach, we derive universal (material-independent) relations between electromagnetic response functions such as the dielectric tensor, the magnetic susceptibility and the microscopic conductivity tensor. Our formulae can be reduced to well-known identities in special cases, but more generally include the effects of inhomogeneity, anisotropy, magnetoelectric coupling and relativistic retardation. If combined with the Kubo formalism, they would also lend themselves to the ab initio calculation of all linear electromagnetic response functions.

cond-mat.mtrl-sci↗

arXiv2017

Covariant Response Theory and the Boost Transform of the Dielectric Tensor

After a short critique of the Minkowski formulae for the electromagnetic constitutive laws in moving media, we argue that in actual fact the problem of Lorentz-covariant electromagnetic response theory is automatically solved within the framework of modern microscopic electrodynamics of materials. As an illustration, we first rederive the well-known relativistic transformation behavior of the microscopic conductivity tensor. Thereafter, we deduce from first principles the transformation law of the wavevector- and frequency-dependent dielectric tensor under Lorentz boost transformations.

physics.class-ph↗

arXiv2017

Linear electromagnetic wave equations in materials

After a short review of microscopic electrodynamics in materials, we investigate the relation of the microscopic dielectric tensor to the current response tensor and to the full electromagnetic Green function. Subsequently, we give a systematic overview of microscopic electromagnetic wave equations in materials, which can be formulated in terms of the microscopic dielectric tensor.

cond-mat.mtrl-sci↗

arXiv2017

Microscopic Theory of the Refractive Index

We examine the refractive index from the viewpoint of modern first-principles materials physics. We first argue that the standard formula, $n^2 = \varepsilon_{\mathrm r} μ_{\mathrm r}$, is generally in conflict with fundamental principles on the microscopic level. Instead, it turns out that an allegedly approximate relation, $n^2 = \varepsilon_{\mathrm r}$, which is already being used for most practical purposes, can be justified theoretically at optical wavelengths. More generally, starting from the fundamental, Lorentz-covariant electromagnetic wave equation in materials as used in plasma physics, we rederive a well-known, three-dimensional form of the wave equation in materials and thereby clarify the connection between the covariant fundamental response tensor and the various cartesian tensors used to describe optical properties. Finally, we prove a general theorem by which the fundamental, covariant wave equation can be reformulated concisely in terms of the microscopic dielectric tensor.

cond-mat.mtrl-sci↗

arXiv2016

Relativistic covariance of Ohm's law

The derivation of Lorentz-covariant generalizations of Ohm's law has been a long-term issue in theoretical physics with deep implications for the study of relativistic effects in optical and atomic physics. In this article, we propose an alternative route to this problem, which is motivated by the tremendous progress in first-principles materials physics in general and ab initio electronic structure theory in particular. We start from the most general, Lorentz-covariant first-order response law, which is written in terms of the fundamental response tensor $χ^μ_ν$ relating induced four-currents to external four-potentials. By showing the equivalence of this description to Ohm's law, we prove the validity of Ohm's law in every inertial frame. We further use the universal relation between $χ^μ_ν$ and the microscopic conductivity tensor $σ_{k\ell}$ to derive a fully relativistic transformation law for the latter, which includes all effects of anisotropy and relativistic retardation. In the special case of a constant, scalar conductivity, this transformation law can be used to rederive a standard textbook generalization of Ohm's law.

math-ph↗