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Titlebook: Conceptual Perspectives in Quantum Chemistry; Jean-Louis Calais,Eugene Kryachko Book 1997 Springer Science+Business Media Dordrecht 1997 c

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发表于 2025-3-21 19:16:01 | 显示全部楼层 |阅读模式
书目名称Conceptual Perspectives in Quantum Chemistry
编辑Jean-Louis Calais,Eugene Kryachko
视频video
图书封面Titlebook: Conceptual Perspectives in Quantum Chemistry;  Jean-Louis Calais,Eugene Kryachko Book 1997 Springer Science+Business Media Dordrecht 1997 c
描述The rivers run into the sea, yet the sea is not full Ecclesiastes What is quantum chemistry? The straightforward answer is that it is what quan­ tum chemists do. But it must be admitted, that in contrast to physicists and chemists, "quantum chemists" seem to be a rather ill-defined category of scientists. Quantum chemists are more or less physicists (basically theoreticians), more or less chemists, and by large, computationists. But first and foremost, we, quantum chemists; are conscious beings. We may safely guess that quantum chemistry was one of the first areas in the natural sciences to lie on the boundaries of many disciplines. We may certainly claim that quantum chemists were the first to use computers for really large scale calculations. The scope of the problems which quantum chemistry wishes to answer and which, by its unique nature, only quantum chemistry can answer is growing daily. Retrospectively we may guess that many of those problems meet a daily need, or are say, technical in some sense. The rest are fundamental or conceptual. The daily life of most quantum chemists is usually filled with grasping the more or less technical problems. But it is at least as important
出版日期Book 1997
关键词chemical bond; perturbation theory; quantum chemistry; quantum electrodynamics; quantum mechanics; struct
版次1
doihttps://doi.org/10.1007/978-94-011-5572-4
isbn_softcover978-94-010-6348-7
isbn_ebook978-94-011-5572-4
copyrightSpringer Science+Business Media Dordrecht 1997
The information of publication is updating

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Maciej Ogrodniczuk,Włodzimierz Gruszczyńskimodel state must be identical to that of the true ground state, and places DFT in the context of the Fermi liquid theory of Landau. The theory of self-interaction corrections is reexamined from this point of view.
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https://doi.org/10.1007/978-94-017-3561-2st. Firstly, potential energy surfaces are classical constructions and beg the question as to what they can mean within quantum theory; secondly, granted the conventional quantum states of molecular species associated with individual minima of PE surfaces through the usual product forms of electroni
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Yingying Zhang,Yu Zhou,Jane McKenzie . philosophical stances (classical realism, reductionism) which other [sic] may subscibe [sic] to” (Woolley 1986, 204). Primas (1981, 252) claims “many of the difficulties… are created by philosophical preconceptions [such as operationalism, logical monism and realism] which we are free to discard
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Recent Developments in Multiple Scattering Theory and Density Functional Theory for Molecules and Smodel state must be identical to that of the true ground state, and places DFT in the context of the Fermi liquid theory of Landau. The theory of self-interaction corrections is reexamined from this point of view.
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,A Philosopher’s Perspective on the “Problem” of Molecular Shape, . philosophical stances (classical realism, reductionism) which other [sic] may subscibe [sic] to” (Woolley 1986, 204). Primas (1981, 252) claims “many of the difficulties… are created by philosophical preconceptions [such as operationalism, logical monism and realism] which we are free to discard
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