Related papers: Reconsidering Power Functional Theory
We show that classical density functional theory can be based on the constrained search method [M. Levy, Proc. Natl. Acad. Sci. 76, 6062 (1979)]. From the Gibbs inequality one first derives a variational principle for the grand potential as…
The elicitation of power priors, based on the availability of historical data, is realized by raising the likelihood function of the historical data to a fractional power {\delta}, which quantifies the degree of discounting of the…
We obtain formulas for the coefficients of positive and negative powers of a partial theta function.
The calculation of the band-gap by density-functional theory (DFT) methods is examined by considering the behavior of the energy as a function of number of electrons. It is found that the incorrect band-gap prediction with most approximate…
The exact reduced density-matrix functional is derived from the Luttinger-Ward functional of the single-particle Green's function. Thereby, a formal link is provided between diagrammatic many-body approaches using Green's functions on the…
An extension of the method and results of A. Schwarz for evaluating the partition function of a quadratic functional is presented. This enables the partition functions to be evaluated for a wide class of quadratic functionals of interest in…
Several combinatorial identities are presented, involving Stirling functions of the second kind with a complex variable. The identities involve also Stirling numbers of the first kind, binomial coefficients and harmonic numbers.
Classical density-functional theory provides an efficient alternative to molecular dynamics simulations for understanding the equilibrium properties of inhomogeneous fluids. However, application of density-functional theory to multi-site…
We present a variational formulation of Time-Dependent Density Functional Theory similar to the constrained-search variational formulation of ground-state density-function theory. The formulation is applied to justify the time-dependent…
This is the revised version of Sect. I - IV of the paper https://doi.org/10.1103/PhysRevD.89.125022 originally published in 2014. The thing is that in https://doi.org/10.1103/PhysRevD.89.125022 the text was insufficiently clear and, in…
The status of multifractional theories is reviewed using comparative tables. Theoretical foundations, classical matter and gravity dynamics, cosmology and experimental constraints are summarized and the application of the multifractional…
In this paper we explore the theory of fractional powers of non-negative (and not necessarily self-adjoint) operators and its amazing relationship with the Chebyshev polynomials of the second kind to obtain results of existence, regularity…
Many generalizations of continued fractions, where the reciprocal function has been replaced by a more general function, have been studied, and it is often asked whether such generalized expansions can have nice properties. For instance, we…
In this paper, we intend to revisit Theorem 2 of [3] formulating it in a way that, weakening the hypotheses and, at the same time, highlighting the richer conclusion allowed by the proof, it can potentially be applicable to a broader range…
Like many other physical quantities, the optical force can be expanded using multipole expansion, which has been done in [Nat. Photon. 5, 531], up to electric octupole order. However, in that study, the existence of radiation multipoles…
The first well founded perturbation theory for classical solid systems is presented. Theoretical approaches to thermodynamic and structural properties of the hard-sphere solid provide us with the reference system. The traditional…
In the paper, we investigate the uniqueness problem of a power of an entire function that share one value partially with it's linear differential polynomial and obtain a result, which improves several previous results in a large scale. Also…
We develop the theory of weighted P-partitions, which generalises the theory of P-partitions from labelled posets to weighted labelled posets. We define the related generating functions in the natural way and compute their product,…
Previously, we have introduced a very small number of examples of what we call Ouroboros functions. Using our already established theory of Ouroboros spaces and their functions, we will provide a set of families of Ouroboros functions that…
A new method ( PI-DFT ) which combines path integrals and density functional theory is proposed as a pathway to many fields of physics. Within path integral theory it is possible to construct particle densities without explicitly…