不同针阔树种造林比例下小兴安岭森林景观的动态模拟

采用空间直观森林景观模型(LANDIS)模拟了不同针、阔树种造林比例(P1,100%阔叶树;P2,70%阔叶树、30%针叶树;P3,50%阔叶树、50%针叶树;P4,30%阔叶树、70%针叶树;P5,100%针叶树)和采伐后完全依赖天然更新(P6)6种预案下2001—2201年小兴安岭友好林业局森林景观的动态变化.结果表明:人工更新造林措施可以有效地促进研究区森林资源的恢复,但单一营造针叶树的预案会使其阔叶树的面积百分比低于P6预案,而单一地营造阔叶树会导致该预案下针叶树的面积百分比低于P6预案;随着针叶树种造林比例的增加,针叶树(红松和落叶松)所占面积比例随之增加;随着阔叶树种造林比例的增加,阔叶树(蒙古栎)所占面积亦随之增加;人工更新造林措施减少了研究区白桦的分布面积.不同的造林措施不仅改变树种所占的面积百分比,还影响其空间格局:随着针叶树种造林比例的增加,针叶树(红松和落叶松)的聚集度指数随之增加;随着阔叶树种造林比例的增加,阔叶树(蒙古栎)的聚集度指数随之增加;人工更新造林措施对白桦的聚集度指数无明显影响.

辽西半干旱区小麦、玉米水肥耦合效应研究

采用 3 12 D最优饱和设计和二次通用旋转组合设计 ,通过 8年连续试验 ,对辽西半干旱区影响农业生产的水、肥因素的耦合作用进行了田间试验 .讨论分析了N、P、水及其耦合作用对作物产量的影响 .施N、施P、灌水和覆盖秸秆的合理匹配能够明显提高作物产量 ,否则 ,不仅增加成本 ,而且由于加重作物的水分或养分胁迫 ,造成减产 .根据试验结果进行了生产要素的产量效益分析 ,提出了该地区小麦、玉米生产的水肥最佳经济配比 :小麦为生育期供水 12 0 .2mm ,N 5 8.5kg·hm-2 ,P2 O512 3 .0kg·hm-2 ;玉米为生育期灌水 173 .3mm ,N 2 5 6.5kg·hm-2 ,P2 O585 .5kg·hm-2 ,覆秸秆 85 0 9.5kg·hm-2 .

旱地长期定位施肥对冬麦水分利用的影响研究

本文在长期定位施肥试验基础上研究了黄土高原旱地不同施肥条件下冬小麦对水分的利用。结果表明 :旱地不同施肥连续 15年种植冬小麦后对土壤剖面含水量影响显著 ,施N或NP配合处理与CK和单施P处理剖面含水量差异均达显著或极显著水平 ,冬小麦对土壤储水的利用深度超过 2 0 0cm ,最大施肥处理N180kg/hm2 P2 O5180kg/hm2 小麦收获后 0～ 40 0cm剖面储水量比CK少 173 .89mm ,高N肥投入产量与生育年降水量显著相关 ,旱地土壤深层储水利用有很大的抗旱增产潜力

陕北新修梯田地膜小麦优化施肥栽培模式研究

采用田间正交旋转试验设计 ,于 1999年在延安市燕沟进行了小麦产量与氮肥 (N)、磷肥 (P2 O5)和有机肥 (M) 3因子 5水平的新修梯田地膜小麦试验。通过对试验结果数学建模及模型分析得出 ,本区影响产量的因子效应为 N >P≈ M,N肥产量效应约为磷肥、有机肥的 3倍 ,有机肥增产趋势在低肥力时最低 ,随着肥力水平提高 ,其增施肥料的增产能力增加 ,而氮肥、磷肥肥效均呈递减趋势 ,即肥效随施肥量增加而减小。还分析了本区小麦单位面积产量≥ 2 5 0 0 kg/ hm2 的优化施肥组合 ,筛选的施肥方案为 N 2 5 1.8～ 2 72 .5 kg/ hm2 ,P2 O510 8.9～136 .5 kg/ hm2 ,有机肥 12 80 0～ 16 40 0 kg/ hm2。均值依次为 2 6 1.1,12 5 .1和 146 0 0 kg/ hm2。

黄土旱塬麦田生态系统物质平衡及评价

根据长武试区 1986～ 1995年的统计资料并结合田间试验 ,对黄土旱塬麦田生态系统的主要物质 (氮、磷、钾 )循环及平衡特征进行了较为系统的分析。结果表明 ,农田中养分的流动量大 ,流通途径少 ,养分循环的开放性大 ,外循环规模大 ,内循环率小 ;系统养分平衡中 N基本保持收支平衡 ,K2 O入不敷出 ,P2 O5 输入大于输出 ;养分输入中 ,人工投入的化肥与有机肥是养分的主要来源 ,输出中 N主要集中于籽粒 ,K2 O主要集中于秸秆 ,P2 O5 主要残留于土壤中。指出在农业生产中 ,应采用秸秆还田以增加钾的投入 ,同时要增加氮肥投入尤其是有机肥的投入 ,而磷应以提高其有效性为主。

Synthesis and Properties of Carbazole Main Chain Copolymers with Oxadiazole Pendant toward Bipolar Polymer Host: Tuning the HOMO/LUMO Level and Triplet Energy

Three new carbazole copolymers, poly(9-(2,5-diarene-[1,3,4]oxadiazole)-carbazole-alt-9-(2-ethylhexyl)-carbazole-3,6-diyl)s (P1), poly(9-(2,5-diarene-[1,3,4]oxadiazole)-2, 7-carbazole-alt-9-(2-ethylhexyl)-3, 6-carbazole-diyl)s (P2), and poly(9-(2,5-diarene-[1,3,4]oxadiazole)-carbazole-alt-9-(2-ethylhexyl)-carbazole-2,7-diyl)s (P3), were synthesized by the Suzuki coupling reaction

Two novel triphenylamine-substituted poly(p-phenylenevinylene) derivatives: synthesis, photo- and electroluminescent properties

Two novel triphenylamine-substituted poly(p-phenylenevinylene) derivatives, P1 and P2, have been successfully synthesized through the Witting-Horner reaction. The structures and properties of the monomers and the resulting polymers were characterized by using H-1 NMR, FT-IR, GPC, TGA, UV-vis absorption spectroscopy, cyclic voltammetry (CV) and electroluminescence (EL) spectroscopy

Hybridization of poly(4-vinyl pyridine)-b-polystyrene-b-poly(4-vinyl pyridine) aggregates in dioxane/water solution

Self-assembly of binary blends of two triblock copolymers of poly(4-vinyl pyridine)-b-polystyrene-b-poly(4-vinyl pyridine), i.e., P4VP(43)-b-PS260-b-P4VP(43) (P1) and P4VP(43)-b-PS366-b-P4VP(43) (P2), in dioxane/water solution was studied. These two triblock copolymers individually tend to form vesicles (P2) and cylindrical micelles (P1) in dilute solution. It was found that copolymer components in the blend, sample preparation method, and annealing time had significant effect on hybridization aggregate morphology. By increasing P1 content in the copolymer blends, fraction of looped and stretched cylinders increased, while fraction of bilayers decreased. Nearly no bilayer was observed when P1 content was above 85 wt%.

Structural stability and electronic properties of Ba2MIrO6 (M = La, Y) by first principles

We investigate the structural stability and electronic properties of ordered perovskite-type compounds Ba2MIrO6 (M = La, Y) by use of density functional theory. Cubic (Fm-3m), rhombohedral (R-3) and monoclinic (P2(1)/n) phases are considered for each compound. It was found that the most energetically stable phase for Ba2YIrO6 and Ba2LaIrO6 is P2(1)/n andR-3, respectively. It is also interesting to find that Ba2YIrO6 in R-3 phase, which was not reported in experiment, has a slightly lower energy than experimentally observed cubic Fm-3m phase.

Novel Re(I) dendrimers: synthesis, characterization and theoretical studies

Four novel diimine rhenium(I) carbonyl complexes with the formula [Re(CO)(3)(L) Br], where L = 2-(4-(9H-carbazol-9-yl) phenyl)-1H-imidazo[4,5-f][1,10] phenanthroline (P1), 2-(4-(3,6-di-tert-butyl-9H-carbazol-9-yl) phenyl)-1H-imidazo-[4,5-f][1,10] phenanthroline (P2), 2-(4-(6-(9H-carbazol-9-yl)-9H-3,9'-bicarbazol-9-yl) phenyl)-1H-imidazo[4,5-f][1,10] phenanthroline (D1), and 2-(4-(3', 6'-di-tert-butyl-6-(3,6-di-tert-butyl-9H-carbazol-9-yl)-9H-3,9'-bicarbazol-9-yl) phenyl)-1H-imidazo[4,5-f][1,10] phenanthroline (D2), have been successfully synthesized and fully characterized by (HNMR)-H-1, IR, and UV-Vis, etc. The luminescence quantum yields (LQYs) of the parent Re(I) complexes P1 and P2 are 0.13 and 0.16, respectively, which are much higher than the previously reported Re(I) dendrimers. The HOMOs and the LUMOs of P1 and P2 are calculated to be mainly composed of [d(Re) + pi(CO + Br)] and pi*(L) orbital, respectively.

Synthesis and Characterizations of Poly(9,10-bisarylethynyl-2,6-anthrylene)s and Poly(9,10-bisalkynyl-2,6-anthrylene)

A poly(9,10-bisalkynyl-2,6-anthrylene) (PI) and five poly(9,10-bisarylethynyl-2,6-anthrylene)s(P2-P6) as soluble conjugated polymers have been synthesized and characterized. All polymers exhibit two-dimensional conjugated characteristics as indicated by absorption spectra comprising multi-bands in the range of 300-600 nm. Compared with P1, polymers P2-P5, which contain phenylethynyl substituents with the longer conjugation than alkynyl groups, exhibit a similar to 60 nm red shift of absorption edge. However, further increasing the conjugation length of the arylethynyl substituents (longer than phenylethynyl) has only a no effect on the conjugation of the polymer chains, while comparing the absorption spectra of P6 with those of P2-P5.

Synthesis and Characterization of One-Dimensional and Molecular M(tren)InAsS4 (M = Mn, Co, and Zn) Compounds with a Noncondensed AsS33- Unit

Four transition-metal-amine complexes incorporating indium thioarsenates with the general formula M(tren)InAsS4 (M=Mn, Co, and Zn) and a noncondensed AsS33- unit have been prepared and characterized. Single-crystal X-ray diffraction analyses show that compound 1 (M=Mn) crystallizes in the triclinic crystal system (space group: P (1) over bar) and consists of a one-dimensional (1D) inorganic (1)(infinity){[InAsS4](2-)} chain and [Mn(tren)](2+) groups bonded to the opposite sides of an eight-membered In2As2S4 ring along the backbone of the infinite inorganic chains. Compounds 2 (M=Mn), 3 (M=Zn), and 4 (M=Co) are isomorphous molecular compounds. They all crystallize in the monoclinic crystal system (space group: P2(1)/c). The Mn2+ cation of [Mn(tren)](2+) in 1 has a distorted octahedral environment, while the transition-metal cations of [M(tren)](2+) in the other three compounds locate in trigonal-bipyramidal environments.

3D 异金属Bi(III)-Pr(III)配位聚合物的合成、晶体结构和热稳定性

在水溶液中合成了双金属配位聚合物({[(NO3)(H2O)3Pr(μ4-Hedta)Bi-(NO3)2].2H2O}2)n,并通过元素分析、红外光谱和X射线单晶衍射等手段进行了表征.该配合物为单斜晶系,P2(1)/n空间群,a=1.26831(18)nm,b=0.82189(12)nm,c=2.3755(3)nm,β=105.055(2)°,R=0.0429,V=2.3913(6)nm3,Z=4.Bi(Ⅲ)-Pr(Ⅲ)间通过配阴离子Hedta3-中4个羧基的桥联作用构建配合物的3D结构.TG-DSC结果表明,该配合物热分解经历脱水、配体分解以及盐分解过程,残余物为Bi-Pr-O的三元复合氧化物.

Crystal structures and elastic properties of superhard IrN2 and IrN3 from first principles

First principles calculations were performed to investigate the structural, elastic, and electronic properties of IrN2 for various space groups: cubic Fm-3m and Pa-3, hexagonal P3(2)21, tetragonal P4(2)/mnm, orthorhombic Pmmn, Pnnm, and Pnn2, and monoclinic P2(1)/c. Our calculation indicates that the P2(1)/c phase with arsenopyrite-type structure is energetically more stable than the other phases. It is semiconducting (the remaining phases are metallic) and contains diatomic N-N with the bond distance of 1.414 A. These characters are consistent with the experimental facts that IrN2 is in lower symmetry and nonmetallic. Our conclusion is also in agreement with the recent theoretical studies that the most stable phase of IrN2 is monoclinic P2(1)/c. The calculated bulk modulus of 373 GPa is also the highest among the considered space groups. It matches the recent theoretical values of 357 GPa within 4.3% and of 402 GPa within 7.8%, but smaller than the experimental value of 428 GPa by 14.7%. Chemical bonding and potential displacive phase transitions are discussed for IrN2. For IrN3, cubic skutterudite structure (Im-3) was assumed.

Naphthyl and thionaphthyl end-capped oligothiophenes as organic semiconductors: Effect of chain length and end-capping groups

Two series of oligothiophenes (OThs), NaTn and TNTn (n = 2-6 represents the number of thiophene rings), end-capped with naphthyl and thionaphthyl units have been synthesized by means of Stille coupling. Their thermal properties, optical properties, single crystal structures, and organic field-effect transistor performance have been characterized. All oligomers display great thermal stability and crystallinity. ne crystallographic structures of NaT2, NaT3, TNT2, and TNT3 have been determined. The crystals of NaT2 and NaT3 are monoclinic with space group P2(1)/C, while those of TNT2 and TNT3 are triclinic and orthorhombic with space groups P-1(-) and P2(1)2(1)2(1), respectively. All oligomers adopt the well-known herringbone packing-mode in crystals with packing parameters dependent on the structure of the end-capping units and the number of thiophene rings. The shorter intermolecular distance in NaT3 compared to NaT2 indicates that the intermolecular interaction principally increases with increasing molecular length. X-ray diffraction and atomic force microscopy (AFM) characterization indicate that the NaTn oligomers can form films with better morphology and high molecular order than TNTn oligomers with the same number of thiophene rings. The NaTn oligomers exhibit mobilities that are much higher than those for TNTn oligomers (0.028-0.39 cm(2) V-1 s(-1) versus 0.010-0.055 cm(2) V-1 s(-1), respectively).