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標(biāo)題: Titlebook: Quantum Chemistry of Organic Compounds; Mechanisms of Reacti Vladimir I. Minkin,Boris Ya. Simkin,Ruslan M. Miny Textbook 1990 Springer-Verl [打印本頁]

作者: Eisenhower    時(shí)間: 2025-3-21 19:23
書目名稱Quantum Chemistry of Organic Compounds影響因子(影響力)




書目名稱Quantum Chemistry of Organic Compounds影響因子(影響力)學(xué)科排名




書目名稱Quantum Chemistry of Organic Compounds網(wǎng)絡(luò)公開度




書目名稱Quantum Chemistry of Organic Compounds網(wǎng)絡(luò)公開度學(xué)科排名




書目名稱Quantum Chemistry of Organic Compounds被引頻次




書目名稱Quantum Chemistry of Organic Compounds被引頻次學(xué)科排名




書目名稱Quantum Chemistry of Organic Compounds年度引用




書目名稱Quantum Chemistry of Organic Compounds年度引用學(xué)科排名




書目名稱Quantum Chemistry of Organic Compounds讀者反饋




書目名稱Quantum Chemistry of Organic Compounds讀者反饋學(xué)科排名





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Potential Energy Surfaces of Chemical Reactions,formation on such a mechanism must include the sequence of these steps (stoichiometric mechanism) as well as the data on their nature. This concerns the data on the structure and energetics of all species involved in the reaction and the solvation shell for every point of the route which leads from
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Effects of the Medium, must take account of effects of the medium, in other words, of the solvent effects. The number of publications is very great devoted to experimental research into the multifarious effects a solvent has on the rate and mechanism of organic reactions which were first detected about one hundred years
作者: 違抗    時(shí)間: 2025-3-23 04:52

作者: Induction    時(shí)間: 2025-3-23 09:26
Substitution Reactions,lyze their mechanism. We shall explore the potentialities of theory and try to show the significance of the calculation data for understanding the essence of a reaction mechanism using as examples some typical reactions of organic chemistry. In our presentation we stick to the conventional classific
作者: CLEAR    時(shí)間: 2025-3-23 10:09
Low-Energy Barrier Reactions. Structural Modelling,on state structure as well as the optimal trajectory for drawing together of the reactants in the zone of its formation. Usual structural changes, such as introduction of substituents, do not substantially alter the configuration of interacting centers in the neighborhood of a transition state, prov
作者: 確定的事    時(shí)間: 2025-3-23 16:48
Radical Reactions,reacting system is usually retained. The calculation of the systems with open electron shells is a rather harder task requiring the use of the UHF approximation and the inclusion of electron correlation corrections. For radical reactions, drawing together of the PES’s of different electron states is
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Pericyclic Reactions,matropic) cycloaddition reactions. The rules of selection of preferable structures for transition states of these reactions based on the principles of orbital approach have found wide acceptance and may serve as an example of an eifective qualitative theory. One should not, however, forget that the
作者: 尖    時(shí)間: 2025-3-24 04:29
Orbital Interactions and the Pathway of a Chemical Reaction,ve and semiquantitative arguments of the theories of conservation of the orbital symmetry [1], and of orientation and stereoselection [2, 3], this concept establishes a clear-cut interconnection among the symmetry properties, the amplitudes of interacting orbitals and the optimal pathways for the approaching reactants.
作者: 新義    時(shí)間: 2025-3-24 06:30
Electron and Proton Transfer Reactions,iated with peculiar features characterizing the intrinsic mechanism of the elementary steps of electron and proton transfer and with the role they play in the overall stoichiometric mechanism of a number of organic and bioorganic reactions.
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reactivity. The Minkin, Simkin, Minyaev book takes us in that direction. It incorporates the lessons of frontier orbital theory and of Hartree-Fock SCF calculations; what chemical physicists have learned about trajectory calculations of selected reactions, and a simplified treatment of all-important solvent e978-3-642-75681-8978-3-642-75679-5
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Vladimir I. Minkin,Boris Ya. Simkin,Ruslan M. Minyaevstruction of an ordinal preference ranking. Part of such a challenge might be the claim that A. and A. are less empirically substantive claims than auxiliary “technical” assumptions, simplifying the theory of choice and rendering it more “mathematically tractable”.
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Vladimir I. Minkin,Boris Ya. Simkin,Ruslan M. Minyaeve relativist, on the other hand, denies the possibility that a single, eternal concept of justice can be derived from knowledge of human nature as such. A concept of justice is valid if it is the posit of recognized authorities or if it reflects culturally specific values. A thoroughgoing relativist
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e Guidelines actually reject market-oriented approaches, and (4) reviews the relevant U.S. and E.U. case-law. Its analysis of conglomerate mergers (1) shows that they can perform the same legitimate and competi978-3-662-52128-1978-3-642-24313-4
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ar operational definitions of all the economic and legal con.Volume 2 uses the economic and legal concepts/theories of Volume 1 to (1) analyze the U.S. and E.U. antitrust legality of ?mergers, joint ventures, and the pricing-technique and contractual/sales-policy distributor-control surrogates for v
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Vladimir I. Minkin,Boris Ya. Simkin,Ruslan M. Minyaev enough about the topic to generate a lively controversy among Marx scholars.. One apparently paradoxical aspect of his thought will be considered here; namely, its affinities to both the natural right and the relativist traditions of justice, traditions which have been in constant opposition to one
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Vladimir I. Minkin,Boris Ya. Simkin,Ruslan M. Minyaev enough about the topic to generate a lively controversy among Marx scholars.. One apparently paradoxical aspect of his thought will be considered here; namely, its affinities to both the natural right and the relativist traditions of justice, traditions which have been in constant opposition to one
作者: cartilage    時(shí)間: 2025-3-28 19:15
enough about the topic to generate a lively controversy among Marx scholars.. One apparently paradoxical aspect of his thought will be considered here; namely, its affinities to both the natural right and the relativist traditions of justice, traditions which have been in constant opposition to one
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http://image.papertrans.cn/q/image/781060.jpg
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https://doi.org/10.1007/978-3-642-75679-5Alkene; Cycloaddition; Electrophilic addition; Quantenchemie; aromatic; carbon; chemistry; control; electron
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Quantum Chemical Methods for Calculating Potential Energy Surfaces,This chapter considers briefly the general theoretical principles of modern quantum mechanical methods for calculating the PES’s and the pathways of chemical reactions and presents a concise characteristic of some particular methods pointing out the most suitable areas of their application.




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