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標題: Titlebook: Elements of Quantum Chemistry; Rudolf Zahradník,Rudolf Polák Book 1980 Rudolf Zahradník, Rudolf Polák 1980 bonding.chemical bond.photochem [打印本頁]

作者: 老鼠系領(lǐng)帶    時間: 2025-3-21 19:32
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作者: atopic-rhinitis    時間: 2025-3-21 23:19
https://doi.org/10.1007/978-1-349-20763-3It was seen in Chapter 5 that the one-electron approximation represents a basic approach to the study of the electronic structure of atoms and molecules, either as a self-contained model or as a starting point for more accurate calculations.
作者: Original    時間: 2025-3-22 00:54

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作者: Crepitus    時間: 2025-3-22 12:38
Managing Creativity in Science and Hi-TechIn this chapter some magnetic properties of systems with closed electronic shells., namely, . and . of this susceptibility will be discussed very briefly. Proton behaviour under NMR conditions has already been mentioned (Section 13.2.4).
作者: 管理員    時間: 2025-3-22 15:56

作者: 管理員    時間: 2025-3-22 19:19

作者: AMEND    時間: 2025-3-22 21:51

作者: 自愛    時間: 2025-3-23 01:48

作者: 大吃大喝    時間: 2025-3-23 06:31

作者: mediocrity    時間: 2025-3-23 12:47
Magnetic Properties of Molecules,In this chapter some magnetic properties of systems with closed electronic shells., namely, . and . of this susceptibility will be discussed very briefly. Proton behaviour under NMR conditions has already been mentioned (Section 13.2.4).
作者: venous-leak    時間: 2025-3-23 15:43

作者: 存心    時間: 2025-3-23 19:58
978-1-4613-3923-6Rudolf Zahradník, Rudolf Polák 1980
作者: DOLT    時間: 2025-3-24 01:29

作者: Coterminous    時間: 2025-3-24 03:08

作者: 同音    時間: 2025-3-24 10:25

作者: 傷心    時間: 2025-3-24 14:26

作者: 開花期女    時間: 2025-3-24 16:07
The Industrialization of Services, the fundamental quantum mechanical equation leads to a complete description of the system. As follows from the two preceding chapters, difficulties lie not in the formulation of the Schr?dinger equation, but in its solution. As even three-particle systems are not exactly solvable, problems interest
作者: 赦免    時間: 2025-3-24 21:44
B. L. MacCarthy,P. G. S. A. Jayarathneor description of this symmetry, . are introduced that transform the original configuration into a physically identical configuration, while the individual points need not return to their original positions. Typical symmetry operations are:
作者: corpus-callosum    時間: 2025-3-24 23:35

作者: 提名的名單    時間: 2025-3-25 04:56

作者: 壯觀的游行    時間: 2025-3-25 09:22

作者: Incompetent    時間: 2025-3-25 11:46

作者: 絕緣    時間: 2025-3-25 19:02
https://doi.org/10.1007/978-3-030-80238-7eir standard state is taken to be zero by convention. The standard state is the stable state of elements at a pressure of 101 kPa at the reaction temperature. For the formation of carbon dioxide from carbon and oxygen [Eq. (15–2)], molecular oxygen is considered to be the standard state of oxygen an
作者: OASIS    時間: 2025-3-25 21:12
An Efficient Knowledge Clustering Algorithm,wever, weak and very weak interactions between systems with closed electronic shells have already been studied for more than a century. No reaction in the chemical sense occurs between these systems under “normal” laboratory conditions. The existence of the liquid state and of molecular crystals is
作者: depreciate    時間: 2025-3-26 02:08
http://image.papertrans.cn/e/image/307631.jpg
作者: Osteons    時間: 2025-3-26 06:32
B. L. MacCarthy,P. G. S. A. Jayarathneor description of this symmetry, . are introduced that transform the original configuration into a physically identical configuration, while the individual points need not return to their original positions. Typical symmetry operations are:
作者: 繼承人    時間: 2025-3-26 11:06

作者: 防御    時間: 2025-3-26 14:47

作者: 混亂生活    時間: 2025-3-26 18:57
Symmetry in Quantum Chemistry,or description of this symmetry, . are introduced that transform the original configuration into a physically identical configuration, while the individual points need not return to their original positions. Typical symmetry operations are:
作者: 啞巴    時間: 2025-3-27 00:11
Atomic Orbitals (AO) and Molecular Orbitals (MO),ss forms a basis for the study of more complicated atoms and even for molecules. The possible modes of graphical representation of the radial and angular parts of hydrogen-type functions — the atomic orbitals — have already been described. Thus only a few remarks will be given here in this connection:
作者: 意見一致    時間: 2025-3-27 03:28
Diatomic Molecules, simplest known diatomic molecule, the molecular hydrogen ion, also belongs in the first group. This system consists of two protons and one electron. The simplicity of this system makes it a suitable link between the theories of atoms and molecules (Fig. 3-4).
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作者: 貝雷帽    時間: 2025-3-27 11:23
Introduction,gher mathematics” at technical universities was the test most feared by chemistry students. However, even then some envisaged the theoretical derivation of information on the properties of molecules from knowledge of the bonding of the component atoms.
作者: 壁畫    時間: 2025-3-27 15:44

作者: 靦腆    時間: 2025-3-27 18:27

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作者: DECRY    時間: 2025-3-28 03:18
Managing Creativity in Organizationsng the limited region of application of the individual versions of the SCF method. It is evident, however, that there is a great number of problems in chemistry that can be successfully studied using simple empirical methods considering all the valence electrons or only the π electrons.
作者: STENT    時間: 2025-3-28 10:17

作者: 合唱隊    時間: 2025-3-28 13:22

作者: Gullible    時間: 2025-3-28 18:31
e computer programmes. Even after World War II the rule of three was considered to be sufficient mathematical knowledge for chemists and the short course of "higher mathematics" at technical universities was the test most feared by chemistry students. However, even then some en- visaged the theoreti
作者: adequate-intake    時間: 2025-3-28 20:55
Managing Complications in Glaucoma Surgerygher mathematics” at technical universities was the test most feared by chemistry students. However, even then some envisaged the theoretical derivation of information on the properties of molecules from knowledge of the bonding of the component atoms.
作者: Myocarditis    時間: 2025-3-29 02:45

作者: tattle    時間: 2025-3-29 03:05
Basic Approximations in the Theory of the Chemical Bond,ing for chemists must be simplified by conversion into .. The mere fact that, as a rule, an isolated system is treated (an atom, a molecule, a solid or a system of several partial subsystems) is a kind of abstraction, as the influence of the surrounding medium, for example the influence of a solvent, is frequently ignored.
作者: Innovative    時間: 2025-3-29 08:15
Many-Electron Atoms, system. The two-electron part of the operator can be simplified (cf. Section 5.5) if the .-th electron is assumed to be exposed to the effect of an averaged potential of all the remaining electrons: .. then depends only on ..:
作者: formula    時間: 2025-3-29 11:26
Examples of the Study of Polyatomic Molecules,ng the limited region of application of the individual versions of the SCF method. It is evident, however, that there is a great number of problems in chemistry that can be successfully studied using simple empirical methods considering all the valence electrons or only the π electrons.
作者: 不公開    時間: 2025-3-29 18:39

作者: anniversary    時間: 2025-3-29 23:34

作者: 壓迫    時間: 2025-3-30 00:52
A Brief Comment on the Development of the Theory of the Chemical Bond,bly to the rationalization of organic and inorganic chemistry (Robinson, Ingold, Arndt, Eistert). The work carried out by their predecessors (Kekulé, Cooper, Butlerov, Werner, and in spatial structure Le Bel and van’t Hoff) is of essential importance.
作者: 寬宏大量    時間: 2025-3-30 07:36
Weak Interactions,ot as rapid, as the distance decreases (it is roughly proportional to its sixth power). This has important consequences: whereas repulsive forces practically cease to be effective at distances greater than the length of chemical bonds, attractive forces are not negligible even at distances of about
作者: concubine    時間: 2025-3-30 09:16

作者: 神圣將軍    時間: 2025-3-30 12:47
An Efficient Knowledge Clustering Algorithm,ot as rapid, as the distance decreases (it is roughly proportional to its sixth power). This has important consequences: whereas repulsive forces practically cease to be effective at distances greater than the length of chemical bonds, attractive forces are not negligible even at distances of about
作者: escalate    時間: 2025-3-30 20:12

作者: Aesthete    時間: 2025-3-30 20:55
A Brief Comment on the Development of the Theory of the Chemical Bond,able agreement with modern knowledge of the quantum theory of the chemical bond and with direct structural determinations using electron or neutron diffraction and .-ray analysis. Only in the theory published in 1916 by Kossel and Lewis did electrons assume a decisive role in concepts of the origin
作者: interpose    時間: 2025-3-31 02:42
,The Time-Independent Schr?dinger Equation,of physics. It is true that we can proceed from the classical law of conservation of energy and, through a number of modifications (some of them inconceivable from the point of view of classical mechanics), arrive at the Schr?dinger equation (“derive it”). However, this procedure does not possess th
作者: 偏見    時間: 2025-3-31 07:16

作者: Original    時間: 2025-3-31 11:48

作者: foodstuff    時間: 2025-3-31 16:40

作者: 先驅(qū)    時間: 2025-3-31 18:37
Many-Electron Atoms,ulsion of the electrons and attraction between the nucleus and the electrons. The expression for the potential energy of the .-th electron assumes the form. where .. is the position vector of the .-th electron. It is assumed that the immobile atomic nucleus is located at the origin of the coordinate
作者: Urea508    時間: 2025-3-31 22:14





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