华东理工大学机构知识库

成果/Result

QSAR analysis of soil sorption coefficients for polar organic chemicals: Substituted anilines and phenols被引量：23收藏 分享

作者：Liu, Gousheng Yu, Jianguo

机构：Jiangxi Sci & Technol Normal Univ;E China Univ Sci & Technol

来源：WATER RESEARCH  2005

关键词：artificial neural networks (ANNs)   substituted anilines and phenols   soil sorption coefficients   QSAR model   polar organic chemicals  

Density functional theoretical study on dehydration process of MgCl₂?6H₂O被引量：10收藏 分享

作者：Liu, GS Song, XF Yu, JG

机构：Jiangxi Sci & Technol Normal Univ;E China Univ Sci & Technol

来源：MAGNESIUM - SCIENCE, TECHNOLOGY AND APPLICATIONS  2005

关键词：density functional theory (DFT)   dehydration   MgCl2 center dot 6H(2)O   bischofite  

Theoretical study on the structure, vibrational frequency and thermodynamic properties of 2,3,7,8-tetrachlorinated dibenzo-p-dioxin被引量：9收藏 分享

作者：Liu, GS Yu, JG

机构：Jiangxi Sci & Technol Normal Univ;E China Univ Chem Technol

来源：JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM  2005

关键词：2,3,7,8-tetrachlorinated dibenzo-p-dioxin (TCDD)   density functional theory (DFT)   semi-empirical molecular orbital method   PM3 Hamiltonian  

Preparation of anhydrous magnesium chloride from MgCl₂?6H₂O thermal decomposition mechanism of the intermediate product被引量：7收藏 分享

作者：Song, XF Wang, J Wang, XT Yu, JG

机构：E China Univ Sci & Technol

来源：MAGNESIUM - SCIENCE, TECHNOLOGY AND APPLICATIONS  2005

关键词：magnesium chloride hex-ammoniate   MgCl2   thermal decomposition kinetics  

Density functional theoretical study of water molecular adsorption on surface of MoO₃ with the cluster model被引量：6收藏 分享

作者：Song, XF Liu, GS Yu, HG Rodrigues, AE

机构：Univ Porto;E China Univ Sci & Technol

来源：JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM  2004

关键词：water molecular adsorption   MoO3   cluster model   density functional theory (DFT)  

Preparation of anhydrous magnesium chloride from bischofite (MgCl₂?6H₂O) I.: Reaction crystallization of magnesium chloride hexammoniate被引量：4收藏 分享

作者：Wang, XT Zhao, JH Song, XF Wang, J Yu, JG

机构：E China Univ Sci & Technol

来源：MAGNESIUM - SCIENCE, TECHNOLOGY AND APPLICATIONS  2005

关键词：magnesium chloride hexammoniate   reaction crystallization   crystal size distribution  

Preparation, characterization and deactivation studies of Co-Mo/γ-Al₂O₃ deoxidizing catalyst被引量：3收藏 分享

作者：Wang, XT Liu, GS Yu, JG Rodrigues, AE

机构：Univ Porto;E China Univ Sci & Technol

来源：APPLIED CATALYSIS A-GENERAL  2004

关键词：Co-Mo/gamma-Al2O3 catalyst   deoxidizing catalyst   deactivation   reactivation