Molecular dynamics study on the phase diagrams of linear and branched chain molecules
文献类型：期刊论文
| 作者 | Ouyang WZ ; Lu ZY ; Sun ZY ; An LJ |
| 刊名 | chemical physics
 |
| 出版日期 | 2008 |
| 卷号 | 344期号:1-2页码:52-60 |
| 关键词 | VAPOR-LIQUID-EQUILIBRIA UNITED-ATOM DESCRIPTION MONTE-CARLO-SIMULATION GIBBS-ENSEMBLE TRANSFERABLE POTENTIALS TRIACONTANE ISOMERS LATTICE POLYMERS N-ALKANES COEXISTENCE FLUIDS |
| ISSN号 | 0301-0104 |
| 通讯作者 | sun zy |
| 中文摘要 | the particle transfer molecular dynamics is used to study the phase equilibria of linear and branched chain molecules. the scaling of the critical temperature versus chain length is obtained and the critical densities are found to decrease with increasing chain length, which are in agreement with the results of experiment and theory. the phase diagrams of the linear and the branched chain molecules nearly overlap with each other. moreover, the radial distribution functions of linear and branched chain molecules in gas phase are very similar, but in the liquid phase, they are different for different kinds of chains. |
| 收录类别 | SCI |
| 语种 | 英语 |
| WOS记录号 | WOS:000253623900005 |
| 公开日期 | 2010-04-14 |
| 源URL | [http://ir.ciac.jl.cn/handle/322003/10287]  |
| 专题 | 长春应用化学研究所_长春应用化学研究所知识产出_期刊论文 |
| 推荐引用方式 GB/T 7714 | Ouyang WZ,Lu ZY,Sun ZY,et al. Molecular dynamics study on the phase diagrams of linear and branched chain molecules[J]. chemical physics,2008,344(1-2):52-60. |
| APA | Ouyang WZ,Lu ZY,Sun ZY,&An LJ.(2008).Molecular dynamics study on the phase diagrams of linear and branched chain molecules.chemical physics,344(1-2),52-60. |
| MLA | Ouyang WZ,et al."Molecular dynamics study on the phase diagrams of linear and branched chain molecules".chemical physics 344.1-2(2008):52-60. |
入库方式： OAI收割
来源：长春应用化学研究所
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