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Note on an Approximation Treatment for Many-Electron Systems

Chr. Møller, +1 more
- 01 Oct 1934 - 
- Vol. 46, Iss: 7, pp 618-622
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TLDR
In this article, a perturbation theory for treating a system of n electrons in which the Hartree-Fock solution appears as the zero-order approximation was developed, and it was shown by this development that the first order correction for the energy and the charge density of the system is zero.
Abstract
A perturbation theory is developed for treating a system of n electrons in which the Hartree-Fock solution appears as the zero-order approximation. It is shown by this development that the first order correction for the energy and the charge density of the system is zero. The expression for the second-order correction for the energy greatly simplifies because of the special property of the zero-order solution. It is pointed out that the development of the higher approximation involves only calculations based on a definite one-body problem.

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TL;DR: In this article, a set of Lennard-Jones parameters were derived from the post-Hartree-Fock calculations to describe the interaction of DNA with the surface of gold, a metal commonly used in biochip technologies.
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Ordered and oriented supramolecular n/p-heterojunction surface architectures: completion of the primary color collection

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Elastic properties of bulk and low-dimensional materials using Van der Waals density functional.

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Structural studies of the water tetramer

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π‐Electron delocalisation for intramolecular resonance assisted hydrogen bonds

TL;DR: In this paper, the authors analyzed π-electron delocalization for intramolecular resonance assisted hydrogen bonds (IRAHBs) and showed that the strength of IRAHBs depends mainly on the process of π electron delocalisation.
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