新型镁合金Mg-Al-Zn-Y光谱标准样品的制备和定值

采用双层安全炉熔炼镁合金和环壁式除渣法清除结晶器中的氧化皮和夹渣等技术,研制了新型镁合金Mg-Al-Zn-Y光谱标准样品.考察了标准样品的均匀性和稳定性,该标准样品有效期为5年.使用先进的数据处理软件(StndMtrl),对多家单位协作分析定值原始数据进行检验和计算,得到标准样品的标准值和标准偏差.用化学法对标准样品进...     

Theoretical study of the interaction between LiNH2 and HMgH

The lithium bond between HMgH and LiNH₂ has been predicted and characterized with quantum chemical calculations at the MP2/6‐311++G(d,p) level. Upon formation of the lithium bond, both the Mg? H and Li? N bonds are stretched. The Li? N bond undergoes a red shift, whereas the Mg? H bond exhibits a blue shift. The lithium‐bonded complex is controlled mainly by electrostatic and polarization interactions. The binding energy of HMgH with LiNH₂ is computed to be 12.47 kcal/mol. The binding of the two molecules is enhanced by the substitution with the methyl group in the Li acceptor, whereas it is weakened by the replacement with whether the electron‐withdrawing group such as F, Cl, CN, NC, or the electron‐donating group (OH and HN₂). A negative cooperativity is present in the ternary system of 2LiNH₂ and HMgH. The polarization interaction plays an important role in the negative cooperativity. © 2009 Wiley Periodicals, Inc. Int J Quantum Chem, 2011     

Magnesium K‐edge XANES spectroscopy of geological standards

Magnesium K‐edge X‐ray absorption near‐edge structure (XANES) spectra have been investigated to develop a systematic understanding of a suite of Mg‐bearing geological materials such as silicate and carbonate minerals, sediments, rocks and chemical reagents. For the model compounds the Mg XANES was found to vary widely between compounds and to provide a fingerprint for the form of Mg involved in geologic materials. The energy positions and resonance features obtained from these spectra can be used to specify the dominant molecular host site of Mg, thus shedding light on Mg partitioning and isotope fractionation in geologic materials and providing a valuable complement to existing knowledge of Mg geochemistry.     

单活泼氢手性配体生成的原位镁催化剂及其在不对称合成中的应用

本文对原位镁催化剂近年的工作进行了总结,对由单活泼氢手性配体生成的原位镁催化剂在不对称合成中的应用进行了系统归纳和分类。介绍了由单氮氢键、单酚羟基和单醇羟基构成的手性配体的设计和发展及其在原位镁催化剂中的应用,实现了多种类型的不对称催化反应过程和化学键的形成方式。对于原位镁催化策略的进一步探索,将有助于研究和推广更多类型廉价环保金属资源催化的化学转化过程。     

激光诱导AZ31B镁合金薄板动态响应实验研究

为分析在激光冲击波作用下AZ31B镁合金薄板背面的动态响应,采用聚偏氟乙烯贴片传感器与数字示波器对强激光诱导的冲击波进行测量,得到压电波形,结合冲击波的传播特性,对弹塑性双波的传播规律进行了研究。结果表明：激光诱导的材料动态响应是快速的;压电波形图反映出的弹性前驱波与塑性加载波传播到靶材背面的时间与理论时间相符;弹性前驱波能量小引发的波形振幅较小,紧随着的塑性加载波能量大并引起较大振幅波动,弹塑性双波卸载过程与紧接着的加载过程导致了压电信号的波动振幅提高。     

An η3‐Bound Allyl Ligand on Magnesium in a Mechanochemically Generated Mg/K Allyl Complex

Milling two equivalents of K[1,3‐(SiMe₃)₂C₃H₃] (=K[A′]) with MgX₂ (X=Cl, Br) produces the allyl complex [K₂MgA′₄] ( 1 ). Crystals grown from toluene are of the solvated species [((η⁶‐tol)K)₂MgA′₄] ([ 1 ?2(tol)]), a trimetallic monomer with both bridging and terminal (η¹) allyl ligands. When recrystallized from hexanes, the unsolvated 1 forms a 2D coordination polymer, in which the Mg is surrounded by three allyl ligands. The C?C bond lengths differ by only 0.028 Å, indicating virtually complete electron delocalization. This is an unprecedented coordination mode for an allyl ligand bound to Mg. DFT calculations indicate that in isolation, an η³‐allyl configuration on Mg is energetically preferred over the η¹‐ (σ‐bonded) arrangement, but the Mg must be in a low coordination environment for it to be experimentally realized. Methyl methacrylate is effectively polymerized by 1 , with activities that are comparable to K[A′] and greater than the homometallic magnesium complex [{MgA′₂}₂].     

硼氢化钾还原肉桂醛合成肉桂醇的工艺研究

针对硼氢化钾还原肉桂醛制备肉桂醇的工艺,研究了反应物的物质的量之比、还原体系、反应时间、反应温度等因素对反应收率的影响.结果表明,在KBH4-THF-CH3CH2OH还原体系中,通过控制n(肉桂醛)∶n(硼氢化钾)=3∶1,在室温下反应1.5h,收率可达92.2%.     

镁合金化学转化膜的制备及其性能研究

在磷酸钠-磷酸二氢铵-高锰酸钾体系中对镁合金进行化学转化处理.研究了磷酸钠、磷酸二氢铵、高锰酸钾、温度、时间和添加剂对转化膜性能的影响.通过对转化膜结构、成分及性能的测试评价,得到了性能较好的化学转化溶液配方:Na3PO4为5g·L-1,NH4H2PO4为15 g· L-1,KMnO4为1g· L-1,添加剂(NH4)6 Mo7O24为0.5g·L-1.由SEM可观察到转化膜的表面成“干枯河床”状.XRD和EDS检测表明,膜层的主要成分是Mg,Al12 Mg17和无定形相,膜层表面主要有Mn,Mg,K,O和Al等元素组成.腐蚀实验和电化学测试表明,添加剂能够降低转化膜的腐蚀率,转化膜较基体的腐蚀电位正移了0.73 V,提高了镁合金的耐蚀性.     

基于J-C模型的镁合金MB2动静态拉伸破坏行为

为了研究不同应力状态和应变率条件下镁合金MB2的拉伸破坏行为,利用材料试验机和分离式Hopkinson拉杆(SHTB),对镁合金MB2的光滑及缺口圆柱试件进行了动静态拉伸加载;拟合得到了镁合金MB2的动静态拉伸本构关系,建立了其修正的Johnson-Cook失效破坏准则,并对不同试件的拉伸破坏行为进行了数值模拟;利用SEM对宏观破坏模式对应的微观损伤机理进行了分析。结果表明,随着应力三轴度的增加,镁合金MB2的等效破坏应变先增大后减小,宏观破坏模式由剪切转为正拉断,微观损伤机制由混合断裂转变为韧窝断裂;而随着应变率的增加,等效破坏应变不断减小,破坏模式不发生改变。Johnson-Cook本构关系和修正后的Johnson-Cook失效破坏准则能较好地拟合动态静态拉伸实验结果并预测不同试件的杯锥形破坏特征。