natural bond orbitals

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• Natural bond orbital — In quantum chemistry, a natural bond orbital or NBO is a calculated bonding orbital with maximum electron density. The NBOs are one of a sequence of natural localized orbital sets that include Natural Atomic Orbitals (NAO), Natural Hybrid… …   Wikipedia

• List of natural satellites — This article is about the moons of planets and dwarf planets. For asteroid or minor planet moons, see Minor planet moon. Objects in the Solar System By orbit …   Wikipedia

• Resonance (chemistry) — For other uses, see Resonance (disambiguation). Two of the contributing structures of nitrogen dioxide In chemistry, resonance or mesomerism [1] is a way of describing delocalized electrons within certain molecules or …   Wikipedia

• Valency interaction formula — The Valency Interaction Formula, or VIF is a method for drawing molecular structural formulas based in quantum mechanics. The mathematical basis for VIF was formulated by Oktay Sinanoglu in a series of five papers published in 1984. [ Sinanoğlu,… …   Wikipedia

• VALBOND — In molecular mechanics, VALBOND is a method for computing the angle bending energy that is based on valence bond theory. [Root, D. M.; Landis, C. R.; Cleveland, T. Valence Bond Concepts Applied to the Molecular Mechanics Description of Molecular… …   Wikipedia

• Lewis structure — The Lewis structure of water. Lewis structures (also known as Lewis dot diagrams, electron dot diagrams, and electron dot structures) are diagrams that show the bonding between atoms of a molecule and the lone pairs of electrons that may exist in …   Wikipedia

• Aufbau principle — The Aufbau principle (from the German Aufbau meaning building up, construction : also Aufbau rule or building up principle) is used to determine the electron configuration of an atom, molecule or ion. The principle postulates a hypothetical… …   Wikipedia

• Density functional theory — Electronic structure methods Tight binding Nearly free electron model Hartree–Fock method Modern valence bond Generalized valence bond Møller–Plesset perturbation theory …   Wikipedia

• Alkane stereochemistry — concerns the stereochemistry of linear alkanes and the linear alkane conformers. The existence of more than one conformation is due to hindered rotation around sp3 hybridised carbon carbon bonds. The smallest molecule with such a chemical bond,… …   Wikipedia

• Decamethyldizincocene — Properties Molecular formula C20H30 …   Wikipedia

• Aufbauprinzip — Das Aufbauprinzip des Periodensystems wird verwendet, um die Anordnung der Elektronen in Atomen, Molekülen oder Ionen zu ermitteln. Dem Prinzip liegt ein hypothetischer Prozess zu Grunde, der das Auffüllen der Hüllen mit Elektronen beschreibt.… …   Deutsch Wikipedia