中国观赏石文化与收藏

以推动人类文明进步发展的观念为先导,以详实的地质学、岩石学、石文化史料为切入点,介绍了我国观赏石文化的起源、发展及现状;阐述了赏石审美的本质、形式、石体标准、传统性、现代性等理论要点及其以小见大、以丑为美的审美理念。对赏石修身养性、以石陶情及赏石文化与道教情结的学术价值进行了评述;对从古至今的中华文化名人为赏石理论的创立、鉴赏、收藏和发展作出的不可磨灭的历史贡献进行了评价。     

The electrochemical synthesis of aminonitriles I. H-cell studies with adiponitrile and azelanitrile

Adiponitrile and azelanitrile were electrochemically hydrogenated to their corresponding aminonitriles in a divided H-cell using Raney nickel powder as the cathode material. The effects of current, temperature, and solvent/supporting electrolyte composition on product selectivities were investigated. Syntheses of the fully hydrogenated diamine by-product increased with increasing current and solution temperature. When a 0.8 M adiponitrile/alcohol/water/ammonium actetate electrolyte was hydrogenated at temperatures of 35–45°C, 6-aminocapronitrile selectivities in the range of 79–97% and current efficiencies of 50–60% were obtained. The optimum applied current was 60 mA for each 2.5 g of catalyst (an apparent current density of 4.8 mA cm^–2). For the case of azelanitrile, reaction selectivities for the partially hydrogenated 9-aminononanenitrile product ranged from 80–93%.     

Surface morphology and nodule formation mechanism of cellulose acetate membranes by atomic force microscopy

By the use of atomic force microscopy (AFM), formation mechanism of nodular structure in cellulose acetate membranes was systematically investigated. Elementary factors affecting the nodule formation were delineated on the basis of both kinetic and thermodynamic considerations. It was shown that (1) the exact nature of nodular structure is thermodynamic equilibrium glassy state; nodular structure will vanish in the rubbery state; (2) the thermodynamic factor affecting nodule formation is the membrane formation temperature; with the membrane formation temperature decreasing, more chain segments are able to form nodular structures; (3) nodule formation is dependent on the segment rearrangement; variation of the solvent environment is the major kinetic factor affecting the segment rearrangement and nodule formation. © 2003 Wiley Periodicals, Inc. J Appl Polym Sci 88: 1328–1335, 2003     

Relative image similarity learning with contextual information for Internet cross-media retrieval

With the fast explosive rate of the amount of image data on the Internet, how to efficiently utilize them in the cross-media scenario becomes an urgent problem. Images are usually accompanied with contextual textual information. These two heterogeneous modalities are mutually reinforcing to make the Internet content more informative. In most cases, visual information can be regarded as an enhanced content of the textual document. To make image-to-image similarity being more consistent with document-to-document similarity, this paper proposes a method to learn image similarities according to the relations of the accompanied textual documents. More specifically, instead of using the static quantitative relations, rank-based learning procedure by employing structural SVM is adopted in this paper, and the ranking structure is established by comparing the relative relations of textual information. The learning results are in more accordance with the human’s recognition. The proposed method in this paper can be used not only for the image-to-image retrieval, but also for cross-modality multimedia, where a query expansion framework is proposed to get more satisfactory results. Extensive experimental evaluations on large scale Internet dataset validate the performance of the proposed methods.     

高柔韧性聚氨酯丙烯酸酯的合成及应用

选用不同结构的多元醇作骨架，合成一系列高性能的聚氨酯丙烯酸树脂，并通过对聚氨酯丙烯酸树脂性能的对比研究，发现以聚丁二烯二元醇为骨架的聚氨酯丙烯酸酯树脂具有极佳的柔韧性和优异的低温耐曲折性。     

酸、碱性条件下茜素红紫外-可见光谱的量子化学研究

茜素红(ARS)是葸醌类化合物中茜草素型的一种,被广泛应用于电化学、光谱学等领域的研究。在酸性溶液中,茜素红主要在260 nm和422 nm处出现明显的吸收峰,而在碱性溶液中吸收峰移动到272 nm和556 nm。为了分析不同溶液环境对茜素红吸收峰波长的影响,本研究在杂化密度泛函方法B3LYP/6-311+(d)水平上优化了ARS分子在酸、碱性情况时的稳定基态构型,并采用含时密度泛函(time-dependent density functional theory,TD-DFT)方法模拟了ARS分子的电子吸收光谱。计算结果与实验得到的紫外可见吸收光谱相吻合,说明密度泛函理论用来研究茜素红的紫外可见光谱是有效可靠的。通过计算还确定了每个吸收峰对应的各个电子跃迁的贡献率以及Mulliken电荷分布。该理论与实验的结合研究为茜草素型化合物的进一步应用、分子设计、药物构效关系和化学反应规律的研究提供了重要的参考依据。     

应用WCA微扰理论推算非极性液体比热容的新方法

本文首次将统计热力学的Ｗｅｅｋｓ－Ｃｈａｎｄｌｅｒ－Ａｎｄｅｒｓｏｎ（简称ＷＣＡ）微扰理论应用于非极性液体定容比热容和定压比热容的推算，用一些液体的ｐ－ｖ－Ｔ实验数据拟合了理论中所用ＬＪ势能函数的势能参数，并提出一个通用关联式。本文方法具有通用性，在编制的计算程序中只需输入物质的临界温度、临界比容、偏心因子等就能算出相应的比热容，工程应用十分方便。     

A kinetic model for polystyrene (PS) pyrolysis reaction

A mathematical model for the pyrolysis reaction of polystyrene (PS) in a semi-batch reactor has been presented. The thermal degradation of PS was flexibly modeled by a combination of random and specific chain-end scissions. Numerical simulation was used to investigate the effect of operating conditions on the PS products spectrum, the results of which were validated by the experimental data. It was found that as the reaction temperature increased (decreased), the monomer fraction in the products became lower (higher) while the trimer higher (lower). No significant variation in the product composition was, however, observed while constant temperature was maintained. These results indicate the reaction temperature is an effective manipulated variable for the control of products composition of PS pyrolysis. The calculation of the optimum temperature trajectories through the optimization study can thus be of interest for achieving productivity enhancement in plastics pyrolysis processes. This paper is dedicated to Professor Dong Sup Doh on the occasion of his retirement from Korea University.