Titlebook: Quantum Computational Chemistry; Modelling and Calcul Taku Onishi Book 2018 Springer Nature Singapore Pte Ltd. 2018 Chemical bonding rule a

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Electron Correlationations is away from universal quantum concept. DFT has the different concept to incorporate electron correlation effect. The electron correlation effect is directly considered to represent the correct exchange-correlation energy. Though universal exchange-correlation functional has not been develope

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Model Constructionso explained in comparison with molecular orbital and band structure. A geometric structure of solid is determined by a short-range chemical bonding and long-range ionic interaction. In a minimum cluster model, a long-range ionic interaction is incorporated by the use of experimental lattice distanc

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Taku Onishirde erweitert. Das Theoriekapitel wurde vollst?ndig neu organisiert, weitere Kapitel gestrafft. -?Mit umfangreichem Download-Angebot: ?Literatur und anderen Künsten und Medien“, ?Literaturtheorie“ sowie L?sungen der Aufgaben..978-3-476-04493-8978-3-476-04494-5

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