中国科学院机构知识库网格系统: 检索

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	Revealing the Initial Chemistry of Soot Nanoparticle Formation by ReaxFF Molecular Dynamics Simulations 期刊论文 OAI收割 ENERGY & FUELS, 2017, 卷号: 31, 期号: 8, 页码: 8434-8444 作者: Han, Song; Li, Xiaoxia; Nie, Fengguang; Zheng, Mo; Liu, Xiaolong \| 收藏 \| 浏览/下载：29/0 \| 提交时间：2017/11/27
	Investigation of Overall Pyrolysis Stages for Liulin Bituminous Coal by Large-Scale ReaxFF Molecular Dynamics 期刊论文 OAI收割 ENERGY & FUELS, 2017, 卷号: 31, 期号: 4, 页码: 3675-3683 作者: Zheng, Mo; Li, Xiaoxia; Nie, Fengguang; Guo, Li 收藏 \| 浏览/下载：19/0 \| 提交时间：2017/09/06
	Initial Reaction Mechanism of Bio-oil High-Temperature Oxidation Simulated with Reactive Force Field Molecular Dynamics 期刊论文 OAI收割 ENERGY & FUELS, 2017, 卷号: 31, 期号: 2, 页码: 1608-1619 作者: Liu, Xiaolong; Li, Xiaoxia; Nie, Fengguang; Guo, Li 收藏 \| 浏览/下载：21/0 \| 提交时间：2017/05/02
	Investigation of model scale effects on coal pyrolysis using ReaxFF MD simulation 期刊论文 OAI收割 MOLECULAR SIMULATION, 2017, 卷号: 43, 期号: 13-16, 页码: 1081-1088 作者: Zheng, Mo; Li, Xiaoxia; Nie, Fengguang; Guo, Li \| 收藏 \| 浏览/下载：31/0 \| 提交时间：2018/01/15 Reaxff Md Model Scale Effect Coal Pyrolysis Large-scale Coal Model Reaction Mechanism
	Reaction analysis and visualization of ReaxFF molecular dynamics simulations 期刊论文 OAI收割 JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2014, 卷号: 53, 期号: sep, 页码: 13-22 作者: Liu, Jian; Li, Xiaoxia; Guo, Li; Zheng, Mo; Han, Junyi 收藏 \| 浏览/下载：34/0 \| 提交时间：2014/12/01 ReaxFF molecular dynamics Large scale simulation VARxMD Chemical reaction analysis and visualization Chemical reaction mechanisms Cheminformatics Chemical reaction parsing Reaction pathway analysis Chemical structure processing
	Internet Motivated Progress in Chemoinformatics 期刊论文 OAI收割 PROGRESS IN CHEMISTRY, 2008, 卷号: 20, 期号: 12, 页码: 1849-1859 作者: Li Xiaoxia; Guo Li; Yuan Xiaolong; Xia Zhaojie; Nie Fengguang 收藏 \| 浏览/下载：29/0 \| 提交时间：2013/10/08 cheminformatics chemistry surface web chemistry deep web open source software repository grid virtual research environment eChemistry