Ab Initio Prediction of ^29Si-NMR Chemical Shifts

The ability of several ab initio models to predict experimental 29Si-NMR chemical shift is examined. The shielding values of trimethylsilyl chloride (A), t-butyldimethylsilyl chloride (B) and allyltrimethylsilane (C) are calculated by GIAO, CSGT and IGAIM methods, using HF/6-31G^*, B3LYP/6-31G^* , HF/6-311 G^**, B3LYP/6-311 G^** and MPWlPW91/6-311 G^** models respectively. The 29Si chemical shifts calculated by GIAO method using HF/6-311 G^** model are highly in agreement with those obtained experimentally. All of the models above reproduce the trends of chemical shifts in all cases studied, suggesting that the models are of practical value.     

银盘恒星运动学和化学丰度与银河系结构

大样本的银盘恒星的运动学数据和元素丰度特征是研究银河系结构及演化，尤其是银盘形成和演化的2个重要探针。本文首先介绍了银河系的总体结构特征，然后较详细的综述了以上2个探针的重要性。对我国LAMOST项目在研究银河系结构方面，尤其是银盘的形成和演化方面的能力作了合理的分析。     

SORPTION AND DESORPTION CHARACTERISTICS OF CADMIUM BY FOUR DIFFERENT SOILS IN NORTHEAST CHINA

1IN TR O D U C TIO NA s a persistentand toxic pollutant, cadm ium (C d) canresultin m any adverse health effects in a variety oftis-suesand organssuch asthe lung,kidney,urinary,blad-der,pancreas,breast and prostate (SA TA R U G etal.,2003).C adm ium in so…     

深层搅拌桩加固软土地基的应用研究

深层搅拌桩广泛用于软基加固工程.当软土含水率＞50%时,可采用喷粉施工;反之,宜采用喷浆施工工艺.水泥土的加固,可用调节搅拌轴回转速度来控制搅拌效果.根据某镇工程实例的工程地质条件,介绍了具体的施工工序,指出严格执行操作规程和确保水泥质量,是保证加固桩体强度与均匀性的关键.施工中必须合理选择施工工艺和实行质量控制,以避免断桩或搅拌不均匀.生产实践表明,深层搅拌桩加固软基工艺成桩快、成本低,有利于环境保护.     

露天采石场边坡稳定性与加固

舟山群岛位于我国南北海运和长江内河航运干线的交汇点，近临上海、宁波等大都市，区域条件独特。区域内岛屿众多，深水港资源集中，渔业、旅游资源丰富，岛内以丘陵山地为主，地少人多。随着国民经济快速发展，船舶修造业建设、劈山造地、围填海涂及各类市政交通建设等日益增多。使舟山放炮开山的露天采石场仍然较多。