Crystal Structure of the Addition Compound of N,N′-Bi(2-pyridylmethyl)-Oxamide and the Complex of Copper with 1,10-Phenanthroline

The structure of addition compound Cu(phen)3(PMoxdH)(CO4)2 was establish ed by means of X-ray crystallography,where PMoxdH is N,N-Bi(2-pyridyl-methyl)-oxamide,in which six nitrogen atoms of the three 1,10,-phen-anthroline bind to the copper ion and the oxygen atom of PMoxdH is uncoordinated.

Electronic Structure Effect on Model Cluster for L1_2 Structure of Al_3Ti Intermetallic Compound with an Addition of Alloying Elements Fe, Ni and Cu

By use of self-consistent field Xα scattered-wave (SCF-Xα-SW) method, the electronic structure was calculated for four models of Ti4Al14X (X=Al, Fe, Ni and Cu) clusters. The Ti4Al14X cluster was developed based on L12 Al3Ti-base intermetallic compound. The results are presented using the density of states (DOS) and one-electron properties, such as relative binding tendency between the atom and the model cluster, and hybrid bonding tendency between the alloying element and the host atoms. By comparing the four models of Ti4Al14X cluster, the effect of the Fe, Ni or Cu atom on the physical properties of Al3Ti-based L12 intermetallic compounds is analyzed. The results indicate that the addition of the Fe, Ni or Cu atom intensifies the relative binding tendency between Ti atom and Ti4Al14X cluster. It was found that the Fermi level (EF) lies in a maximum in the DOS for Ti4Al14Al cluster; on the contrary, the EF comes near a minimum tn the DOS for Ti4Al14X (X=Fe, Ni and Cu) cluster. Thus the L12 crystal structure for binary Al3Ti alloy is unstable, and the addition of the Fe, Ni or Cu atom to Al3Ti is benefical to stabilize L12 crystal structure. The calculation also shows that the Fe, Ni or Cu atom strengthens the hybrid bonding tendency between the central atom and the host atoms for Ti4Al14X cluster and thereby may lead to the constriction of the lattice of Al3Ti-base intermetallic compounds.

Improvement of AlN Thermal Conductivity Based on Reductive Compound Additives

AlN ceramics were prepared by plasma activation sintering(PAS)with compound additives yttrium acetylacetonate(Y(acac)_(3))and melamine(C_(3)H_(6)N_(6)).The effects of compound additives on the microstructure,density,and thermal properties of Al N ceramic were studied.Y(acac)3and C_(3)H_(6)N_(6)can form Y_(2)O_(3),residual organic carbon and reducing gas during the heating process,which improves the Al N sintering performance at a temperature of 1700℃and the bulk thermal conductivity.When the content of Y(acac)_(3)is 10 wt%and C_(3)H_(6)N_(6)is 3 wt%,the thermal conductivity of Al N ceramics is 105.6 W/(m·K),which is much higher than that of Al N ceramics with Y_(2)O_(3)under the same sintering conditions.This work provides theoretical reference for the preparation of high-performance Al N ceramic.

Effects of Ultrafine Comminution on the Dissolution of Active Ingredients from Compound Feed Additive of Strobilanthes cusia

[Objective] The research aimed to explore the effects of comminution technology on the dissolution of active components from compound feed additive of Strobi/anthes cusia. [Method] Using active component adenosine in principal herb S. cusia and chlorogenic acid in minister drug Lonicera japonica Thunb. as dissolution indices,the effects of ultrafine comminution on the dissolution degree of compound feed additive of S. cusia were analyzed. [ Result] The dissolution degree of adenosine and chlorogenic acid in ultra micro particles were obviously higher than that of common particles. Ultrafine comminution could significantly quicken the dissolution rate of adenosine and chlorogenic acid in compound feed additive of S. cusia, shorten the extraction time, avoid the breakage of active components in long-time extraction process,and meanwhile saved the energy greatly. [ Conclusion] The ultrafine comminution technology could obviously increase the dissolution degree of active components in compound feed additive of S. cusia.

Study on extracting alumina from fly ash by compound additive activation method

According to the chemical and mineral composition characteristics of the fly ash,alumina can be extracted from fly ash through the calcining method by using sodium carbonate and calcium carbonate additives.The effects on leaching rate of alumina have been investigated. The results showed that the fly ash can be activated effectively and the leaching rate of alumina can be improved to more than 92% through this method. The best process parameters were the ratio of raw materials,i. e. the material weight ratio of fly ash,calcium carbonate and sodium carbonate was 1. 0∶1. 2∶0. 9. The activating temperature was 850℃-900℃,activating time was 3 h. This process has a potential application prospect and improves the value of comprehensive utilization of fly ash.

Additive Engineering for Stable and Efficient Dion-Jacobson Phase Perovskite Solar Cells

Because of their better chemical stability and fascinating anisotropic characteristics,Dion-Jacobson(DJ)-layered halide perovskites,which owe crystallographic two-dimensional structures,have fascinated growing attention for solar devices.DJ-layered halide perovskites have special structural and photoelectronic features that allow the van der Waals gap to be eliminated or reduced.DJ-layered halide perovskites have improved photophysical characteristics,resulting in improved photovoltaic performance.Nevertheless,owing to the nature of the solution procedure and the fast crystal development of DJ perovskite thin layers,the precursor compositions and processing circumstances can cause a variety of defects to occur.The application of additives can impact DJ perovskite crystallization and film generation,trap passivation in the bulk and/or at the surface,interface structure,and energetic tuning.This study discusses recent developments in additive engineering for DJ multilayer halide perovskite film production.Several additive-assisted bulk and interface optimization methodologies are summarized.Lastly,an overview of research developments in additive engineering in the production of DJ-layered halide perovskite solar cells is offered.

Molecular Dynamic Simulation on the Absorbing Process of Isolating and Coating of α-olefin Drag Reducing Polymer

The absorbing process in isolating and coating process of α-olefin drag reducing polymer was studied by molecular dynamic simulation method, on basis of coating theory of α-olefin drag reducing polymer particles with polyurethane as coating material. The distributions of sodium laurate, sodium dodeeyl sulfate, and sodium dodeeyl benzene sulfonate on the surface of α-olefin drag reducing polymer particles were almost the same, but the bending degrees of them were obviously different. The bending degree of SLA molecules was greater than those of the other two surfactant molecules. Simulation results of absorbing and accumulating structure showed that, though hydrophobie properties of surfactant molecules were almost the same, water density around long chain sulfonate sodium was bigger than that around alkyl sulfate sodium. This property goes against useful absorbing and accumulating on the surface of α-olefin drag reducing polymer particles; simulation results of interactions of different surfactant and multiple hydroxyl compounds on surface of particles showed that, interactions of different surfaetant and one kind of multiple hydroxyl compound were similar to those of one kind of surfaetant and different multiple hydroxyl compounds. These two contrast types of interactions also exhibited the differences of absorbing distribution and closing degrees to surface of particles. The sequence of closing degrees was derived from simulation; control step of addition polymerization interaction in coating process was absorbing mass transfer process, so the more closed to surface of particle the multiple hydroxyl compounds were, the easier interactions With isoeyanate were. Simulation results represented the compatibility relationship between surfactant and multiple hydroxyl compounds. The isolating and coating processes of α-olefin drag reducing polymer were further understood on molecule and atom level through above simulation research, and based on the simulation, a referenced theoretical basis was provided for practical optimal selection and experimental preparation of α-olefin drag reducing polymer particles suspension isolation agent.

Mechanical Properties of ZrO_2 Ceramic Stabilized by Y_2O_3 and CeO_2

ZrO2 ceramic was made from evenly dispersed ( Y, Ce)-ZrO2 powder with different compositions , which was prepared by the chemical coprecipitation, and stabilized by compound additions through appropriate techniques. And its mechanical property that is related to the phase content and its microstructwe was studied by X-ray diffraction(XRD) , scan electron microscope( SEM). The results show that Y2O3 has stronger inhibition to the growth of ZrO2 crystal than CeO2 has. Therefore, within an appropriate composition range of Y2 O3 and CeO2, the higher the content of Y2O3, the lower the content of CeO2 , the smaller ZrO2 crystal. Combining this feature and the stabilization technique with complex additions instead of simple addition, ZrO2 ceramic with high density and excellent mechanical properties can be made under normal conditions. It is concluded that the improvement of mechanical properties originates from the toughening of microcrack, phase transformation and the effect of grain e-vulsions.

Effects of Nano Chinese Herbal Medicine Feed Additive on Growth Performance,Meat Quality and Disease Resistance of Chickens

[Objectives]To explore the effects of nano compound Chinese herbal medicine feed additive on growth performance,meat quality and disease resistance of chickens.[Methods]Chickens were fed with nano compound Chinese herbal medicine feed additive developed by Hunan Polytechnic of Environment and Biology,including 120 chickens in the treatment group and 120 chickens in the control group(CK).The growth performance indices(body weight gain,feed to gain ratio and slaughter index),meat quality indices(pH value,color,drip loss,shear force)and disease resistance indices(morbidity and mortality)of the chickens in the treatment and CK groups were recorded and determined,respectively.[Results]The inclusion of 2%nano compound Chinese herbal medicine feed additive in the diet significantly increased the growth rate,reduced the feed-to-gain ratio and improved the meat quality of the chickens.Supplementing Chinese herbal medicine could increase the pH value and reduce the drip loss and shear force of chicken meat.At the same time,the body's immune function,antioxidant level and resistance against diseases of the chickens fed with nano compound Chinese herbal medicine feed additive were improved.[Conclusions]The inclusion of nano compound Chinese herbal medicine feed additive in the diet can improve the growth performance,meat quality and disease resistance of chickens.

Regioselective synthesis of linalyl compounds via addition reaction of geranyl bromide and tin with carbonyl compounds

Linalyl alkyl or aryl carbinols were regioselectively synthesized by the reaction of geranyl bromide and powdered tin with aldehydes and ketones.

Formation of Hybrid Ring Structure of Cyanurate/Isocyanurate in the Reaction be-tween 2,4,6-Tris(4-Phenyl-Phenoxy)-1, 3,5-Triazine and Phenyl Glycidyl Ether

Reaction products of 2,4,6-tris(4-phenyl-phenoxy)-1,3,5-triazine derived from 4-phenylphenol cyanate ester and phenyl glycidyl ether were analyzed. In addition to an isocyanurate compound and an oxazolidone compound which were well known as reaction products of cyanate esters and epoxy resins, compounds with hybrid ring structure of cyanurate/isocyanurate were determined. Gibbs free energies of the compound having hybrid ring structure of cyanurate/isocyanurate with two isocyanurate moiety were found to be lower than that of the compound with cyanurate ring structure through calculations. Calculation data supported the existence of hybrid ring structure of cy-anurate/isocyanurate. It was revealed that isomerization from cyanurate to isocyanurate occurs via hybrid ring structure of cyanurate/isocyanurate in the reaction of aryl cyanurate and epoxy.

Nucleophilic imidoesterification of dicarbonyl compounds with cyanatobenzenes through C-C bond formation

Under neat conditions,an efficient method for synthesis of imidoesters has been developed using cyanatobenzenes and dicarbonyl compounds.Nucleophilic addition spontaneously occurred between the two kinds of materials at room temperature with yields of up to 90%.A mechanism directed towards to the imidoester formation has been proposed.

Colorimetric and fluorimetric detection of cysteine: Unexpected Michael addition–elimination reaction

The synthesis of three isomers based on Michael addition mechanism for the detection of sulfurcontaining species in aqueous solution is described. These compounds are constructed by conjugating an enone to a coumarin fluorophore. A substituted-phenyl（o, m, or p-） was appended at the carbonyl carbon to adjust the reactivity. The experimental results showed that（E）-7-（diethylamino）-3-（3-（3-hydroxyphenyl）-3-oxoprop-1-en-1-yl）-2H-chromen-2-one（m-QPS） and（E）-7-（diethylamino）-3-（3-（4-hydroxyphenyl）-3-oxoprop-1-en-1-yl）-2H-chromen-2-one（p-QPS） barely react with sulfur-containing nucleophiles, while（E）-7-（diethylamino）-3-（3-（2-hydroxyphenyl）-3-oxoprop-1-en-1-yl）-2H-chromen-2-one（o-QPS） exhibited a fast response toward sulfite, sulfide and thiols in DMSO/phosphate buffer（2：1）. The above results are probably due to the intramolecular H-bonding activated Michael addition.More interestingly, cysteine triggered unusual photophysical responses of o-QPS： the original absorption（488 nm） and emission peaks（573 nm） underwent significant blue shifts initially and then recovered,which might be caused by the Michael addition and elimination reaction, respectively.

Odour reducing microbial-mineral additive for poultry manure treatment

Poultry production systems are associated with emissions of odorous volatile organic compounds （VOCs）, ammonia （NH3）, hydrogen sulfide （HES）, greenhouse gases, and particulate matter. Development of mitigation technologies for these emissions is important. Previous laboratory-scale research on microbial-mineral treatment has shown to be effective for mitigation of NH3, H2S and amines emissions from poultry manure. The aim of this research was to assess the effectiveness of surface application of a microbial-mineral treatment for other important odorants, i.e., phenolics and sulfur-containing VOCs. Microbial-mineral litter additive consisting of 20% （w/w） of bacteria powder （six strains ofheterotrophic bacteria） and 80% of mineral carrier （perlite-bentonite） was used at a dose of 500 g·m^-2 （per -31 kg of manure）. Samples of air were collected m two series, 4 and 7 days after application of additives. An odor profile of the poultry manure was determined using simultaneous chemical and sensory analysis. Reduction levels of VOCs determined on Day 4 was between 31% and 83% for mineral adsorbent treatment and in the range of 9% and 96% for microbial-mineral additive, depending on the analyzed compound. Reduction levels on Day 7 were considerably lower than on Day 4, suggesting that the odorous VOCs treatment efficacy is relatively short. There was no significant difference between treatments consisting of microbial-mineral additive and mineral carrier alone.

Synthesis and insecticidal activities of novel bridged-neonicotinoids

A series of novel bridged-neonicotinoid analogues were designed and synthesized, which were constructed by starting material 8 with cyclopentenone or cyclohexenone in the presence of catalyst aluminium chloride. All of the compounds were characterized and confirmed by^1H NMR,^（13）C NMR, HRMS and IR. The bioassay tests showed that compounds 5 and 6a showed higher bioactivities than imidacloprid against Aphis craccivora.