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排序方式: 共有333条查询结果,搜索用时 15 毫秒
91.
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Iva Vránová Dr. Mercedes Alonso Dr. Roman Jambor Prof. Aleš Růžička Dr. Milan Erben Dr. Libor Dostál 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(22):7376-7380
The reaction of stibinidene and bismuthinidene ArM [where Ar=C6H3‐2,6‐(CH=NtBu)2; M=Sb ( 1 ), Bi ( 2 )] with transition metal (TM) carbonyls Co2(CO)8 and Mn2(CO)10 produced unprecedented ionic complexes [(ArM)2Co(CO)3]+[Co(CO)4]? and [(ArM)2Mn(CO)4]+[Mn(CO)5]? [where M=Sb ( 3 , 5 ), Bi ( 4 , 6 )]. The pnictinidenes 1 and 2 behaved as two‐electron donors in this set of compounds. Besides the M→TM bonds, the topological analysis also revealed a number of secondary interactions contributing to the stabilization of cationic parts of titled complexes. 相似文献
93.
Dr. Jindřich Fanfrlík Dr. Jan Řezáč Dr. Paul D. Lane Dr. Derek A. Wann Dr. Drahomír Hnyk Prof. Aleš Růžička Prof. Pavel Hobza 《Chemphyschem》2016,17(21):3373-3376
Halogen bonds are a subset of noncovalent interactions with rapidly expanding applications in materials and medicinal chemistry. While halogen bonding is well known in organic compounds, it is new in the field of boron cluster chemistry. We have synthesized and crystallized carboranes containing Br atoms in two different positions, namely, bound to C‐ and B‐vertices. The Br atoms bound to the C‐vertices have been found to form halogen bonds in the crystal structures. In contrast, Br atoms bound to B‐vertices formed hydrogen bonds. Quantum chemical calculations have revealed that halogen bonding in carboranes can be much stronger than in organic architectures. These findings open new possibilities for applications of carboranes, both in materials and medicinal chemistry. 相似文献
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Reduction of barium sulfate by methane was investigated in this work. The thermogravimetric method was used to obtain kinetic parameters of the reaction in the temperature range of 900–975 °C at atmospheric pressure. The kinetics of the reaction has been studied both in the absence and presence of zinc oxide as a catalyst. The conversion–time data have been interpreted by using the grain model, and the effect of catalyst on the kinetic parameters has been elucidated. It was found that zinc oxide acted as fairly strong catalyst for the reaction, especially at higher temperatures. At about 975 °C the reaction rate constant was increased more than 7 times by using 2% of zinc oxide. This enhancement in the rate constant is valuable for industries. 相似文献
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Lenka Chvátalová Roman Čermák Aleš Mráček Ondřej Grulich Alenka Vesel Petr Ponížil Antonín Minařík Uroš Cvelbar Lubomír Beníček Petr Sajdl 《European Polymer Journal》2012,48(4):866-874
This paper is focused on the chemical and morphology changes in the surface of poly(1-butene) (PB-1) generated by plasma treatment. The radio frequency capacitively coupled plasma (air, argon, argon then allylamine, argon containing ammonia and argon with octafluorocyclobutane) was used. Modified surface of PB-1 was characterized by contact angle measurements, X-ray photoelectron spectroscopy, and atomic force microscopy. The surface hydrophilization by air and argon with ammonia plasmas was evaluated as most sufficient. Oppositely, a high level of hydrophobicity of PB-1 surface was reached by combination of argon with octafluorocyclobutane plasma. Upon plasma modification, hydrophilicity/hydrophobicity of treated surfaces remained stable within three days under air atmosphere and then values of contact angle slowly recovered to those of unmodified PB-1. However, morphology and surface chemical composition of plasma-modified samples remained generally unchanged during observed time. Changes in surface hydrophilicity/hydrophobicity of plasma-treated PB-1 were attributed to variance of conformation of the surface molecules. 相似文献
99.
Pavol Brunovský Aleš Černý Ján Komadel 《European Journal of Operational Research》2018,264(3):1159-1171
We study optimal liquidation of a trading position (so-called block order or meta-order) in a market with a linear temporary price impact (Kyle, 1985). We endogenize the pressure to liquidate by introducing a downward drift in the unaffected asset price while simultaneously ruling out short sales. In this setting the liquidation time horizon becomes a stopping time determined endogenously, as part of the optimal strategy. We find that the optimal liquidation strategy is consistent with the square-root law which states that the average price impact per share is proportional to the square root of the size of the meta-order (Bershova & Rakhlin,2013; Farmer et?al., 2013; Donier et?al., 2015; Tóth (2016).Mathematically, the Hamilton–Jacobi–Bellman equation of our optimization leads to a severely singular and numerically unstable ordinary differential equation initial value problem. We provide careful analysis of related singular mixed boundary value problems and devise a numerically stable computation strategy by re-introducing time dimension into an otherwise time-homogeneous task. 相似文献
100.
Pavel Drábek Gabriela Holubová Aleš Matas Petr Nečesal 《Applications of Mathematics》2003,48(6):497-514
In this paper we present several nonlinear models of suspension bridges; most of them have been introduced by Lazer and McKenna. We discuss some results which were obtained by the authors and other mathematicians for the boundary value problems and initial boundary value problems. Our intention is to point out the character of these results and to show which mathematical methods were used to prove them instead of giving precise proofs and statements. 相似文献