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The formal foundation of TDDFT is the Runge–Gross (RG) theorem (1984) [1] – the time-dependent analogue of the Hohenberg–Kohn (HK) theorem (1964). [2] The RG theorem shows that, for a given initial wavefunction, there is a unique mapping between the time-dependent external potential of a system and its time-dependent density.
Density functional theory (DFT) is a computational quantum mechanical modelling method used in physics, chemistry and materials science to investigate the electronic structure (or nuclear structure) (principally the ground state) of many-body systems, in particular atoms, molecules, and the condensed phases.
In model theory, a branch of mathematical logic, the diagram of a structure is a simple but powerful concept for proving useful properties of a theory, for example the amalgamation property and the joint embedding property, among others.
In particular, the Löwenheim-Skolem theorem implies that any theory in a countable signature with infinite models has a countable model as well as arbitrarily large models. [ 6 ] In a certain sense made precise by Lindström's theorem , first-order logic is the most expressive logic for which both the Löwenheim–Skolem theorem and the ...
In physics and engineering, a free body diagram (FBD; also called a force diagram) [1] is a graphical illustration used to visualize the applied forces, moments, and resulting reactions on a free body in a given condition. It depicts a body or connected bodies with all the applied forces and moments, and reactions, which act on the body(ies).
A model completion for a theory T is a model companion T* such that for any model M of T, the theory of T* together with the diagram of M is complete. Roughly speaking, this means every model of T is embeddable in a model of T* in a unique way. If T* is a model companion of T then the following conditions are equivalent: [3] T* is a model ...
The Moore–Aronszajn theorem goes in the other direction; it states that every symmetric, positive definite kernel defines a unique reproducing kernel Hilbert space. The theorem first appeared in Aronszajn's Theory of Reproducing Kernels, although he attributes it to E. H. Moore. Theorem. Suppose K is a symmetric, positive definite kernel on a ...
It is often preferable to work directly with these as they contain all the information that the full correlation functions contain since any disconnected diagram is merely a product of connected diagrams. By excluding other sets of diagrams one can define other correlation functions such as one-particle irreducible correlation functions.