量子化学方法研究氯代苯酚类化合物对水生物毒性的构效关系

对20个氯代苯酚类化合物进行了CNDO/2量子化学计算,讨论了化合物电子结构与其对水生物翻车鱼(Bluegill)、花鳉鱼(Guppy)、和虾(Shrimp)半致死量之间的关系,分别获得了表示其构效关系的三个线性方程,它们的显著性均远高于α=0.01水平。结果表明:氯代苯酚化合物苯环上碳原子的兀电荷之和(∑Qπ_R)越大苯环上碳原子的净电荷之和(∑Q_R)越大,或LUMO轨道能(E_(LUMO))越低,均使化合物对Bluegill和Guppy水生物的毒性增大;而化合物苯环上羟基邻位的碳原子的兀电荷布居(P_3)越大,同时HOMO轨道能E_(HOMO)越高,则化合物对Shrimp毒性也越大。据此,可预测氯代苯酚类化合物对上述三种水生物的毒性。     

瞬变电磁法在断层含水性评价中的应用

本文介绍了瞬变电磁法在煤矿水文地质勘探中的具体应用效果.采用瞬变电磁法对落差较大断层的含(导)水性进行测量,不仅可有效地控制断层的空间位置,而且可定性地判断断层的富水性,其测量结果与已知水文地质资料吻合较好.     

黄土土性的空间自相关性研究

运用土层的随机场模型研究了绛帐、潼关和延安黄土主要物理力学指标沿深度的统计规律,计算出黄土土性的自相关距离,探讨了黄土土性的空间变异性,结果认为:黄土的物理力学指标沿深度均是统计非均匀的,在实际工程的设计中,如果把土层看成统计均匀,其土性参数的标准差会比实际情况大,从而会导致较大的误差。     

经纬仪大尺寸工业测量系统定向法及精度分析

根据工业测量系统的基本原理,通过对系统定向方法及精度的分析与评定,阐述了系统定向方法,保证系统测量结果的精度性及可靠性。     

Sequences in the Hardness Ratio-Peak Energy Plane of Gamma-Ray Bursts

The narrowness of the distribution of the peak energy of the vFv spectrum of gamma-ray bursts (GRBs) and the unification of GRB populations are great puzzles yet to be solved. We investigate the two puzzles based on the global spectral behaviors of different GRB populations, the long GRBs, the short GRBs, and the X-ray flashes (XRFs), in the HR - Ep plane (HR the spectral hardness ratio) with BATSE and HETE-2 observations. It is found that the long GRBs and the XRFs observed by HETE-2 seem to follow the same sequence in the HR-Ep plane, with the XRFs at the low end of this sequence. We fit the sequence by a universal Band function, and find that this sequence is mainly defined by the low energy index α, and is insensitive to the high energy index,β. With fixed β=-5, a best fit is given by α=-1.00 with X^2min/dof=2.2. The long and short GRBs observed by BATSE follow significantly different sequences in the HR-Ep plane, with most of the short GRBs having a larger hardness ratio than the long GRBs at a given Ep. For the long GRBs a best-fit yields α=-0.30 and β=-2.05. For the short GRBs, a best fit gives α=-0.60 with x^2min=1.1 (withβfixed at-2.0 because it is numerically unstable). The α value for the short GRBs is significantly greater than that for the long GRBs. These results indicate that the global spectral behaviors of the long GRB sample and the XRF sample are similar, while that of the short GRBs is different. The short GRBs seem to be a unique subclass of GRBs, and they are not the higher energy extension of the long GRBs.