Non-oxidative decomposition of methane/methanol mixture over mesoporous Ni-Cu/Al2O3 Co-doped catalysts

Thermocatalytic decomposition of methane (TCD) is reported to be a promising and green route of hydrogen generation, however, the relatively fast catalyst deactivation is the main drawback of this technology. This article reports an attempt to increase the catalyst deactivation time by using Cu promoted Ni-based catalyst, and methanol premixed methane gas as a feedstock. The catalysts were prepared by wet impregnation method and characterized by TGA, BET, XRD, TPR, FESEM, Raman and TEM. An inevitable decline in surface area from 5.15 to 4.52 m²g^-1 due to the addition of 15%Cu on 50%Ni/Al₂O₃ was due to the agglomeration of particles and pore blockage of γ -Al₂O₃ support. Moreover, the reduction of NiO was shifted towards lower temperature by successful impregnation of Cu promoter. The overlapping peaks of NiO and CuO confirmed the formation of mixed oxides Ni_x Cu _(1-x) O via XRD analysis. The catalytic activity of both catalysts showed that 50%Ni-15%Cu/Al₂O₃ resulted in better methane conversion 75% at 1023 K TOS for 6 h. The post reaction analysis of the catalysts revealed that carbon in the form of CNF got deposited on the surface of the catalyst having amorphous and crystalline morphology. Finally, TEM also revealed that GF, CNF, and MWCNF were encapsulated over the surface of 50%Ni-15%Cu/Al₂O_3.     

Ti-48Al-2Nb-2Cr合金热变形行为及本构关系研究

采用Gleeble-1500热力模拟机对铸态Ti-48Al-2Nb-2Cr合金进行高温变形热压缩试验,变形温度范围为1050~1200℃,应变速率范围为0.001~0.1s^-1,压缩变形量为60%。研究该合金高温变形温度和应变速率与流变应力之间的关系,计算了合金激活能,并建立了Ti-48Al-2Nb-2Cr合金的Arrhenius本构模型和多元线性回归的本构模型。结果表明,该合金的激活能随温度升高和应变速率增大而增大;Arrhenius本构模型的相关系数为0.98228,平均相对误差为9.97%,相对误差在10%以内的点只占62.0%;而采用多元线性回归本构模型的相关系数为0.99566,平均相对误差为4.76%,相对误差在10%以内的点占92.6%,本构精度较高。     

Alloy optimisation of bainitic steel for large plastic mould

Based on the phase transformation theories, especially the T₀ concept of bainite transformation, alloy optimisation of bainitic steel with carbides has been carried out aiming at the produce of plastic mould with large cross-section. The effect of manganese and silicon on proeutectoid ferrite and bainite transformation is explored by dilatometric analysis, XRD and different microscopy techniques. The results show that after the alloy optimisation, the transformation of proeutectoid ferrite is suppressed and when the cooling rate is lower than 0·1°C?s^??1, the new lower bainite transformation appears by decreasing carbon capacity of austenite and promoting carbide precipitation. Industrial production proves that the optimised alloy SDP1 can meet the demand for the plastic mould with the thickness of 1050?mm.     

Thermodynamic assessments of the U–Nb–Mo and U–Nb–Cr ternary systems

The thermodynamic assessments of the U–Nb–Mo and U–Nb–Cr systems have been performed by using the CALPHAD (Calculation of Phase Diagrams) method on the basis of critical evaluation of phase diagram data reported in literature. The reported individual solution phases, i.e. liquid, (αU), (βU), γ, δ and two intermetallic compounds, i.e. MoU₂ and NbCr₂, have been modeled. The modeling covers the whole composition range and a wide temperature range. By utilizing the available thermodynamic parameters of the sub-binary systems, the U–Nb–Mo and U–Nb–Cr systems have been thermodynamically assessed and a series of self-consistent parameters have been obtained for the first time, which can reproduce most of the phase diagram and thermodynamic data to provide guidance for the design of nuclear fuels.     

Accelerated exploration of multi-principal element alloys for structural applications

A strategy for accelerated discovery and exploration of multi-principal element alloys was developed and used to identify new alloys within a design window of desired microstructures and properties. As an example, the strategy was applied to analyze thousands of 3- 4-, 5- and 6-component alloys at equiatomic compositions of the alloying elements. Currently available thermodynamic databases were used to assess equilibrium phase diagrams for these alloys. The validity and reliability of the calculated phase diagrams were estimated based on the extent of experimental binary and ternary data used to build the respective thermodynamic databases. Alloys with specific characteristics, such as single-phase solid solution alloys with the use temperature above 1000 °C, were identified using an automated analysis of the calculated phase diagrams. The density, elastic moduli and costs of these alloys were estimated using the rule of mixtures of pure elements and were used as additional criteria for alloy selection. This approach allowed rapid, albeit preliminary, screening of many thousands of alloys and identification of promising candidate compositions, some of which are reported in this paper, for more time intensive experimental validations and assessments.     

Synergistic effect of co-alloying elements on site preferences and elastic properties of Ni3Al: A first-principles study

The site preferences of co-alloying elements (Mo–Ta, Mo–Re, Mo–Cr) in Ni₃Al are studied using first-principles calculations, and the effects of these alloying elements on the elastic properties of Ni₃Al are evaluated by elastic property calculations. The results show that the Mo–Ta, Mo–Re and Mo–Cr atom pairs all prefer Al–Al sites and the spatial neighbor relation of substitution sites almost has no influence on the site preference results. Furthermore, the Young's modulus of Ni₃Al increases much higher by substituting Al–Al sites with co-alloying atoms, among which Mo–Re has the best strengthening effect. The enhanced chemical bondings between alloying atoms and their neighbor host atoms are considered to be the main strengthening mechanism of the alloying elements in Ni₃Al.     

Material design and development: From classical thermodynamics to CALPHAD and ICME approaches

This paper presents an overview and examples of material design and development using (1) classical thermodynamics; (2) CALPHAD (calculation of phase diagrams) modeling; and (3) Integrated Computational Materials Engineering (ICME) approaches. Although the examples are given in lightweight aluminum and magnesium alloys for structural applications, the fundamental methodology and modeling principles are applicable to all materials and engineering applications. The examples in this paper have demonstrated the effectiveness and limitations of classical thermodynamics in solving specific problems (such as nucleation during solidification and solid-state precipitation in aluminum alloys). Computational thermodynamics and CALPHAD modeling, when combined with critical experimental validation, have been used to guide the selection and design of new magnesium alloys for elevated-temperature applications. The future of material design and development will be based on a holistic ICME approach. However, key challenges exist in many aspects of ICME framework, such as the lack of diffusion/mobility databases for many materials systems, limitation of current microstructural modeling capability and integration tools for simulation codes of different length scales.     

等离子冷床炉单次熔炼制备Ti-2Al-1.5Mn合金

主要介绍了等离子冷床炉单次熔炼制备Ti-2Al-1.5Mn钛合金铸锭在化学成分、组织、内部品质等方面的情况。结果表明,首次使用PAM炉单次熔炼法制备出航空领域工业级厚330mm、宽750mm、长1 000~2 500mm的钛合金扁锭,其化学成分可控且均匀性较好,纵横向组织均匀细小。此外,获得PAM炉单次熔炼法制备的钛合金扁锭全截面低倍组织图谱特征。铸锭经加工变形后获得的板材产品理化性能满足技术要求。     

热稳定处理时间对TNM合金糊状区组织的影响

利用真空非自耗电弧炉制备了TNM(Ti-44Al-4Nb-1Mo-0.1B at.%)合金锭,研究其铸态组织形貌,并利用Bridgeman定向凝固装置对TNM合金进行热稳定处理实验,分析热稳定处理时间对合金定向凝固糊状区的影响。实验结果显示,其铸态组织是以(α₂+γ)片层团为主体,网络状B2相、细小的γ相及硼化物分布于片层团间的近片层组织。热稳定处理时,热稳定时间越长、TNM合金固/液界面越平整,界面前沿温度场和溶质场趋向均匀,但从减少坩埚对熔体的污染的角度考虑,热稳定处理时间不宜过长,30~60 min的热稳定时间即可提供平整的定向凝固启动界面。 热稳定处理影响着TNM合金固/液界面附近固液两相中Al元素的分布,进而影响硼化物的分布。