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| Theoretical study on the water-catalyzed reaction of glyoxal with OH radical 期刊论文
Journal of Molecular Structure: THEOCHEM, 2010, 期号: 956
作者: Bo Long ; Xing-feng Tan; Da-sen Ren; Wei-jun Zhang
 Adobe PDF(743Kb) |  收藏 | 浏览/下载：449/154 | 提交时间：2011/09/23 |
| Density functional study of hydrogen adsorption and dissociation on small Pdn (n = 1–7) clusters 期刊论文
Journal of Molecular Structure: THEOCHEM, 2009, 期号: 910
作者: Meiyan Ni; Zhi Zeng
Adobe PDF(758Kb) | 收藏 | 浏览/下载：629/296 | 提交时间：2010/02/01 |
| Theoretical investigation on the mechanism and kinetics of toluene-OH adduct with oxygen molecule 期刊论文
Journal of Molecular Structure: THEOCHEM, 2008, 卷号: 862
作者: Mingqiang Huang; Weijun zhang; Zhenya Wang; Liqing Hao; Wenwu Zhao; Xianyun Liu; Bo Long; Li Fang
Adobe PDF(427Kb) | 收藏 | 浏览/下载：291/140 | 提交时间：2012/11/22 |
| Theoretical study of N–H H–B blue-shifted dihydrogen bond 期刊论文
Journal of Molecular Structure: THEOCHEM, 2007, 卷号: 814
作者: Yong Yang; Weijun Zhang
Adobe PDF(153Kb) | 收藏 | 浏览/下载：326/104 | 提交时间：2012/11/23 |
| Theoretical study of the intramolecular hydrogen bonds of aromatic peroxy radicals from OH–toluene reactions 期刊论文
Journal of Molecular Structure: THEOCHEM, 2006, 卷号: 774
作者: Mingqiang Huang; Weijun Zhang; Yong yang; Zhenya Wang; Liqing Hao; Wenwu Zhao; Weixiong Zhao; Jinsong Li; Xiaoming Gao
Adobe PDF(214Kb) | 收藏 | 浏览/下载：525/181 | 提交时间：2012/12/10 |
| Theoretical studies on the substitution reactions CH3X+H→CH4+X (X=F, Cl, Br) 期刊论文
Journal of Molecular Structure: THEOCHEM, 2006, 卷号: 758
作者: Yong Yang; Weijun Zhang; Xiaoming Gao
Adobe PDF(190Kb) | 收藏 | 浏览/下载：353/160 | 提交时间：2012/12/10 |
| Computational study of hydrogen bonding interaction between formamide and nitrosyl hydride 期刊论文
Journal of Molecular Structure: THEOCHEM, 2006, 卷号: 778
作者: Ying Liu; Wenqing Liu; Haiyang Li; Yong Yang; Shuang Cheng
Adobe PDF(183Kb) | 收藏 | 浏览/下载：519/329 | 提交时间：2012/12/05 |
