| 升温速率对金属熔化和过热的影响 |
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| 引用本文： | 张涛 刘新 华英杰 孟长功. 升温速率对金属熔化和过热的影响[J]. 大连轻工业学院学报, 2003, 22(4): 250-255 |
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| 作者姓名： | 张涛 刘新 华英杰 孟长功 |
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| 作者单位： | [1]大连中联油国际贸易有限公司，辽宁大连116001 [2]大连理工大学化学系，辽宁大连116024 [3]海南师范学院化学系，海南海口571158 |
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| 基金项目： | 国家自然科学基金资助项目(20273012). |
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| 摘 要： | 采用分子动力学方法和QSC(Quantum Sutton-Chen)力场研究了升温速率对金属银和金属铅的熔化和过热行为的影响。研究结果表明，升温速率对金属银和铅的熔化和过热行为有很大影响，随着升温速率的升高，金属的熔点有所升高。高的升温速率会导致金属体系内部无序化程度增加，降低了熔化相变的能垒。升温速率导致的银和铅完美晶体的过热极限分别为1450K和800K。
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| 关 键 词： | 分子动力学方法 金属熔化 过热 升温速率 金属银 金属铅 |
| 文章编号： | 1005-4014(2003)04-0250-06 |
Ag melting and superheating at high heating rate |
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| ZHANG Tao,LIU Xin,HUA Ying-Jie,MENG Chang-gong. Ag melting and superheating at high heating rate[J]. Journal of Dalian Institute of Light Industry, 2003, 22(4): 250-255 |
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| Authors: | ZHANG Tao LIU Xin HUA Ying-Jie MENG Chang-gong |
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| Affiliation: | ZHANG Tao~1,LIU Xin~2,HUA Ying-Jie~3,MENG Chang-gong~2 |
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| Abstract: | Molecular dynamics simulation and QSC field are employed to study bulk Ag and Pb superheating and melting behaviors at high heating rate. It reveals that the superheating and melting behavior are strongly affected by the heating rate; the larger the heating rate, the higher the melting temperature. There is an upper limit of heating rate for the induced superheating. The heating rate induced randomization is the main reason to eliminate the energy barrier for phase transformation ocurring at high heating rate and it accounts for the existence of dynamic limit of superheating. The upper limit of heating rate induced superheating of perfect Ag crystal is determined to be around 1?450?K and that of perfect Pb crystal is 800?K. |
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| Keywords: | molecular dynamics simulations melting superheating Pb Ag |
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