基于从头计算法的三维碳同素异形体结构设计

由于独特的成键特性,在不同温度和压强下,碳具有丰富的结构特性。除了实验上已发现各种同素异形体,理论计算也预言了丰富的新结构。在本文中,我们对第一性原理计算预言的三维碳同素异形体做了综述,特别地,我们着重关注了泡沫状的碳结构。碳泡沫主要由石墨片断以各种碳键连接而成,具体多孔结构及较大的表面积。另外,针对由低维碳结构,如碳富勒烯、纳米芽、纳米管及石墨烯等组成的三维碳超结构以及其他三维碳晶体我们也做了概述。这些新型碳结构有的由混杂的sp-sp²碳或者纯sp²碳组成(H-6, bct-4, C-20, K₄等),有的质量密度比金刚石还大(C₈, hP3, tl12, tp12等),有的可以由石墨在室温高压下转化而成(M碳, bct-4碳, W碳, Z碳等)。在这些预言的碳同素异形体中,有些在将来可能在实验室合成。     

基于聚氨酯的磁性碳化泡沫的制备及其吸油性能研究

以废弃聚氨酯泡沫(PUF)为原料,在其表面依次修饰聚丙烯酸(PAA)、Fe3+,然后在230℃条件下,通过高温碳化处理,制备了具有多孔结构的磁性碳化泡沫材料.用光学显微镜、红外吸收光谱(FTIR)、X-射线衍射(XRD)、接触角对磁性碳化泡沫进行表征.详细考察了AA含量、Fe3+浓度对材料吸附容量、吸附速率的影响.材料具有明显的亲油、疏水特性,对各种有机溶剂和油类分子吸附容量都在10 g/g以上,而且在5 min内就可吸附饱和,同时材料密度小,可漂浮于水面对有机溶剂进行快速吸附,并通过外界磁场实现快速分离.因此,该材料在原油泄漏处理、油水分离、油田采出液处理、工业污水净化等领域具有重要的应用价值.     

毛竹屑与玉米淀粉共液化产物制备聚氨酯泡沫研究

采用单因素试验设计,研究了液化剂组成、液比以及毛竹屑与淀粉的比例对液化产物理化性质、及所制备的聚氨酯泡沫材料的物理力学指标影响.结果显示当以50％乙二醇＋50％碳酸亚乙酯混合物作为液化剂、添加相当于液化剂质量3%的浓硫酸为催化剂、在(150±5)℃（油浴）和常压条件下,液化150 min,搅拌速度30 r/min,取得本试验条件下最好的竹屑液化效果,液化产物中竹屑含量25%,残渣率3.96%,但该液化产物中天然聚合物碎片含量少,所制备的聚氨酯泡沫材料塌陷;竹屑与玉米淀粉共液化有效提高了液化产物中生物质的含量,但占液化剂质量25%竹屑+占液化剂质量125%玉米淀粉共液化产物粘度太高（8.85 Pa.s）;而20%竹屑+130%玉米淀粉的共液化产物与4,4′-二苯基甲烷二异氰酸酯以及各种助剂按异氰酸酯基/羟基摩尔比为1.1配合时,所制备的聚氨酯泡沫材料表观密度为33.6 kg/m3、压缩强度118 kPa、弹性模量6.91 MPa,在周年生物降解试验中,该生物质基聚氨酯硬质泡沫失重率为12.63%.     

A multi point conductivity measurement system for characterisation of protein foams

Protein foams play an important role in both food and biotechnological processes. A sound understanding of foaming properties of proteins relevant to such processes is useful e.g. to allow adequate control of unwanted foams and appropriate choice of protein-physical system when foams of certain characteristics are required. In general, measurements of changes in foam volume (volumetric method) are used for foam characterisation. However, recently there has been increased interest in the use of measurement methods based on conductivity and capacitance. Simple relative techniques based on electrical conductivity measurements provide information on both foamability and foam stability. A multi point conductivity measurement system has been designed and used for characterisation of model protein foams (0.1 and 1.0 mg ml⁻¹ Bovine serum albumin, BSA). The solution of BSA was sparged with nitrogen or carbon dioxide gas at constant flow rate (90 cm³ min⁻¹) via a stainless steel sinter (0.5 or 2.0 μm in pore size). A comparison of foaming properties determined by volumetric and conductimetric techniques is provided. Both methods show that more stable foams are obtained for solutions at higher BSA concentrations. At all BSA concentrations, higher foamability and stability are achieved with a smaller sinter pore size. When nitrogen rather than carbon dioxide is used as a dispersed phase, higher foamability and foam stability are obtained. The conductivity measurements indicate that foamability is dependent on gas type, whereas, volumetric measurements do not show such differences.     

Unusually stable liquid foams

Obtaining stable liquid foams is an important issue in view of their numerous applications. In some of these, the liquid foam in itself is of interest, in others, the liquid foam acts as a precursor for the generation of solid foam. In this short review, we will make a survey of the existing results in the area. This will include foams stabilised by surfactants, proteins and particles. The origin of the stability is related to the slowing down of coarsening, drainage or coalescence, and eventually to their arrest. The three effects are frequently coupled and in many cases, they act simultaneously and enhance one another. Drainage can be arrested if the liquid of the foam either gels or solidifies. Coalescence is slowed down by gelified foam films, and it can be arrested if the films become very thick and/or rigid. These mechanisms are thus qualitatively easy to identify, but they are less easy to model in order to obtain quantitative predictions. The slowing down of coarsening requests either very thick or small films, and its arrest was observed in cases where the surface compression modulus was large. The detail of the mechanisms at play remains unclear.     

Towards local rheology of emulsions under Couette flow using Dynamic Light Scattering

We present local velocity measurements in emulsions under shear using heterodyne Dynamic Light Scattering. Two emulsions are studied: a dilute system of volume fraction φ = 20% and a concentrated system with φ = 75%. Velocity profiles in both systems clearly show the presence of wall slip. We investigate the evolution of slip velocities as a function of shear stress and discuss the validity of the corrections for wall slip classically used in rheology. Focussing on the bulk flow, we show that the dilute system is Newtonian and that the concentrated emulsion is shear-thinning. In the latter case, the curvature of the velocity profiles is compatible with a shear-thinning exponent of 0.4 consistent with global rheological data. However, even if individual profiles can be accounted for by a power law fluid (with or without a yield stress), we could not find a fixed set of parameters that would fit the whole range of applied shear rates. Our data, thus, raise the question of the definition of a global flow curve for such a concentrated system. These results show that local measurements are a crucial complement to standard rheological tools. They are discussed in the light of recent works on soft glassy materials. Received 1 November 2002 and Received in final form 8 January 2003 / Published online: 1 April 2003 RID="a" ID="a"e-mail: salmon@crpp.u-bordeaux.fr     

Instabilities in foam clusters related to the pressures in the bubbles

We reinterpret an instability in a two-dimensional free foam cluster previously discussed by Weaire et al. (Eur. Phys. J. E 7, 123 (2002)) in terms of the excess pressure in the bubbles. We conclude that in a free foam cluster no bubble can have a pressure below that of the surrounding gas. Received: 20 September 2002 / Accepted: 5 May 2003 / Published online: 27 May 2003 RID="a" ID="a"e-mail: fatima.vaz@ist.utl.pt