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Titlebook: Intermolecular Forces; Bernard Pullman Book 1981 Springer Science+Business Media B.V. 1981 NMR.ab initio calculation.bonding.spectroscopy.

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樓主: Falter
41#
發(fā)表于 2025-3-28 15:49:51 | 只看該作者
Correlated States in Polyenes and Ion-Radical Organic Solids,-overlapping, open-shell systems. Site representations and valence bond (VB) methods are required for such correlated electronic states. The complete CI problem in models based on one valence state per site is treated by diagrammatic VB theory by expanding correlated states in terms of conventional
42#
發(fā)表于 2025-3-28 19:29:30 | 只看該作者
43#
發(fā)表于 2025-3-29 00:26:36 | 只看該作者
,“New” Molecular Bound and Resonance States,ere that “new” bound and resonance states can occur in a variety of problems involving coupled wave equations. Several examples are discussed, the most important one involving the bound and resonance states of van der Waals complexes.
44#
發(fā)表于 2025-3-29 06:12:28 | 只看該作者
45#
發(fā)表于 2025-3-29 10:37:15 | 只看該作者
46#
發(fā)表于 2025-3-29 14:15:30 | 只看該作者
Studies of Intermolecular Forces by Vibrational Spectroscopy,spectroscopy at low temperatures, their small frequency shift Δν needs small half width of bands. The sign of Δν of bending modes of XH groups is able to differ between van der Waals forces and H-bonds. The Badger-Bauer rule relation between Δν and H-bond energy is discussed as well as the relation
47#
發(fā)表于 2025-3-29 16:49:13 | 只看該作者
Intermolecular Forces and Spectra in Weak Charge Transfer Interactions,l reactivity, probably the most characteristic property of EDA complexes is the appearance of an intense absorption band that is not present in the separated donor and acceptor species. This band, often broad and structureless, usually is in the visible and/or near ultraviolet regions, giving rise i
48#
發(fā)表于 2025-3-29 21:29:20 | 只看該作者
49#
發(fā)表于 2025-3-30 00:13:19 | 只看該作者
Electrostatic and Topological Interactions in DNA, Poisson-Boltzmann equation. The importance of the ions correlation and of the short range interactions is evaluated. The influence of the interactions between the different DNA molecules on the activity coefficients of the co-ions and of the counter-ions is studied. The Pois son-Boltzmann equation
50#
發(fā)表于 2025-3-30 05:34:53 | 只看該作者
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