Citation: BAI Ming-Ze, CHENG Li, TANG Hong, DOU Yu-Sheng. Molecular Dynamics Simulation of the Laser-Induced Melting of an Al Nanofilm[J]. Acta Physico-Chimica Sinica, ;2010, 26(12): 3143-3149. doi: 10.3866/PKU.WHXB20101224 shu

Molecular Dynamics Simulation of the Laser-Induced Melting of an Al Nanofilm

BAI Ming-Ze ¹ ,
CHENG Li ¹ ,
TANG Hong ¹ ,
DOU Yu-Sheng ^1,2,

1.
1. Institue of Computational Chemistry, Chongqing University of Posts and Telecommunications, Chongqing 400065, P. R. China;
2. Department of Physical Sciences, Nicholls State University, LA 70310, USA

Received Date: 22 July 2010
Available Online: 10 November 2010
Fund Project: 国家自然科学基金(20773618, 21073242) (20773618, 21073242)重庆邮电大学自然科学基金(A2008-39)资助项目 (A2008-39)

A coupled computational technique, which combines the one dimensional two-temperature model and molecular dynamics, was used to study the melting dynamics of a nanoscale aluminum film irradiated by a femtosecond laser pulse. The model is capable of providing an atomic-level depiction of fast microscale processes in metals and gives an adequate description of laser light absorption, energy transfer, and fast electron heat conduction in metals. The simulation revealed that the electron temperature, lattice temperature, and laser induced pressure of the Al film were significantly different from those of Ni and Au films. The Al film melts globally soon after laser radiation and this is different from the Ni film, which es through a step melting process. In addition, the Al film shows a much faster melting process than the Ni and Au films because of strong electron-phonon coupling. The melting time of the Al film by an ultrafast laser pulse is consistent with recent experimental observations, which supports the assertion that the laser induced melting of an Al film is a thermal process.
- Metal Al,
- Laser melting,
- Two-temperature model,
- Ultrafast dynamics,
- Thermal melting
1. [1]
  
  1. Tabata, N.; Yagi, S.; Hishii, M. J. Mater. Process. Technol., 1996,62: 309
2. [2]
  2. Yeo, C. Y.; Tam, S. C.; Jana, S.; Lau, M.W. J. Mater. Process.Technol., 1994, 42: 15
3. [3]
  3. Sun, Z.; Ion, J. C. J. Mater. Sci., 1995, 30: 4205
4. [4]
  4. Gu, B. Proceedings of the Society of Photo-Optical Instrumentation Engineers (SPIE), 2006, 61: 10601
5. [5]
  5. Wang, C.W.; Qu, S. Y.;Wang, X. H.; Sun. J. H. Machinist Metal Forming, 2008, 8: 38. [王承伟, 曲仕尧, 王新洪, 孙俊华. 金属加工: 热加工, 2008, 8: 38]
6. [6]
  6. Cao, X.; Jahazi, M.; Immarigeon, J. P.;Wallace,W. J. Mater. Process. Technol., 2006, 171: 188
7. [7]
  7. Guo, C.; Rodriguez, G.; Lobad, A.; Taylor, A. J. Phys. Rev. Lett., 2000, 84: 4493
8. [8]
  8. Kandyla, M.; Shih, T.; Mazur. E. Phys. Rev. B, 2007, 75: 214107
9. [9]
  9. Siwick, B. J.; Dwyer, J. R.; Jordan, R. E.; Miller, R. J. D. Science, 2003, 302: 1382
10. [10]
  10. Dwyer, J. R.; Jordan, R. E.; Hebeisen, C. T.; Harb, M.; Ernstorfer, R.; Dartigalongue, T.; Miller, R. J. D. J. Mod. Opt., 2007, 54: 905
11. [11]
  11. Rahman, A. Phys. Rev. A, 1964, 136: 405
12. [12]
  12. Stillinger, F. H.; Rahman, A. J. Chem. Phys., 1974, 60: 1545
13. [13]
  13. Hou, H. Y.; Chen, G. L.; Chen, G. Acta Phys. -Chim. Sin., 2006, 22: 771. [侯怀宇, 陈国良, 陈光. 物理化学学报, 2006, 22: 771]
14. [14]
  14. Zhang, T.; Zhang, X. R.;Wu, A. L.; Guan, L.; Xu, C. Y. Acta Phys. -Chim. Sin., 2003, 19: 709. [张弢, 张晓茹, 吴爱玲, 管立, 徐昌业. 物理化学学报, 2003, 19: 709]
15. [15]
  15. Zhou, G. R.; Li, B. Q.; Geng, H. R.; Teng, X. Y.; Chen, G. L. Acta Phys. -Chim. Sin., 2007, 23: 1071. [周国荣, 李蓓琪, 耿浩然, 腾新营, 陈广利. 物理化学学报, 2007, 23: 1071]
16. [16]
  16. Xin, J. T.; Zhu,W. J.; Liu, C. L. Explosion and Shock Waves, 2004, 24: 207. [辛建婷, 祝文军, 刘仓理. 爆炸与冲击, 2004, 24: 207]
17. [17]
  17. Anisimov, S. I.; Kapeliovich, B. L.; Perel'man, T. L.; Eksp, Z. Soviet Physics-JETP, 1974, 39: 375
18. [18]
  18. Ivanov, D. S.; Zhigilei, L. V. Phys. Rev. B, 2003, 68: 22
19. [19]
  19. Schäfer, C.; Urbassek, H. M.; Zhigilei, L. V. Phys. Rev. B, 2002, 66: 4
20. [20]
  20. Daw, M. S.; Baskes, M. I. Phys. Rev. Lett., 1983, 50: 1285
21. [21]
  21. Daw, M. S.; Baskes, M. I. Phys. Rev. B, 1984, 29: 6443
22. [22]
  22. Zhou, X.W.;Wadley, H. N. G.; Johnson, R. A.; Larson, D. J.; Tabat, N.; Cerezo, A.; Petford-Long, A. K.; Smith, G. D.W.; Clifton, P. H.; Martens, R. L.; Kelly, T. F. Acta Mater., 2001, 49: 4005
23. [23]
  23. Volkov, A. N.; Zhigilei, L. V. Journal of Physics Conference Series, 2007, 59: 640
24. [24]
  24. Tas, G.; Maris, H. J. Phys. Rev. B, 1994, 49: 15046
25. [25]
  25. Morris, J. R.; Song, X. J. Chem. Phys., 2002, 116: 9352
1. [1]
  Shule Liu . Application of SPC/E Water Model in Molecular Dynamics Teaching Experiments. University Chemistry, 2024, 39(4): 338-342. doi: 10.3866/PKU.DXHX202310029
2. [2]
  Yiying Yang , Dongju Zhang . Elucidating the Concepts of Thermodynamic Control and Kinetic Control in Chemical Reactions through Theoretical Chemistry Calculations: A Computational Chemistry Experiment on the Diels-Alder Reaction. University Chemistry, 2024, 39(3): 327-335. doi: 10.3866/PKU.DXHX202309074
3. [3]
  Yue Wu , Jun Li , Bo Zhang , Yan Yang , Haibo Li , Xian-Xi Zhang . Research on Kinetic and Thermodynamic Transformations of Organic-Inorganic Hybrid Materials for Fluorescent Anti-Counterfeiting Application information: Introducing a Comprehensive Chemistry Experiment. University Chemistry, 2024, 39(6): 390-399. doi: 10.3866/PKU.DXHX202403028
4. [4]
  Xuzhen Wang , Xinkui Wang , Dongxu Tian , Wei Liu . Enhancing the Comprehensive Quality and Innovation Abilities of Graduate Students through a “Student-Centered, Dual Integration and Dual Drive” Teaching Model: A Case Study in the Course of Chemical Reaction Kinetics. University Chemistry, 2024, 39(6): 160-165. doi: 10.3866/PKU.DXHX202401074
5. [5]
  Xiaohui Li , Ze Zhang , Jingyi Cui , Juanjuan Yin . Advanced Exploration and Practice of Teaching in the Experimental Course of Chemical Engineering Thermodynamics under the “High Order, Innovative, and Challenging” Framework. University Chemistry, 2024, 39(7): 368-376. doi: 10.3866/PKU.DXHX202311027
6. [6]
  Ruming Yuan , Pingping Wu , Laiying Zhang , Xiaoming Xu , Gang Fu . Patriotic Devotion, Upholding Integrity and Innovation, Wholeheartedly Nurturing the New: The Ideological and Political Design of the Experiment on Determining the Thermodynamic Functions of Chemical Reactions by Electromotive Force Method. University Chemistry, 2024, 39(4): 125-132. doi: 10.3866/PKU.DXHX202311057
7. [7]
  Yaling Chen . Basic Theory and Competitive Exam Analysis of Dynamic Isotope Effect. University Chemistry, 2024, 39(8): 403-410. doi: 10.3866/PKU.DXHX202311093
8. [8]
  Jinfu Ma , Hui Lu , Jiandong Wu , Zhongli Zou . Teaching Design of Electrochemical Principles Course Based on “Cognitive Laws”: Kinetics of Electron Transfer Steps. University Chemistry, 2024, 39(3): 174-177. doi: 10.3866/PKU.DXHX202309052
9. [9]
  Yeyun Zhang , Ling Fan , Yanmei Wang , Zhenfeng Shang . Development and Application of Kinetic Reaction Flasks in Physical Chemistry Experimental Teaching. University Chemistry, 2024, 39(4): 100-106. doi: 10.3866/PKU.DXHX202308044
10. [10]
  Dexin Tan , Limin Liang , Baoyi Lv , Huiwen Guan , Haicheng Chen , Yanli Wang . Exploring Reverse Teaching Practices in Physical Chemistry Experiment Courses: A Case Study on Chemical Reaction Kinetics. University Chemistry, 2024, 39(11): 79-86. doi: 10.12461/PKU.DXHX202403048
11. [11]
  You Wu , Chang Cheng , Kezhen Qi , Bei Cheng , Jianjun Zhang , Jiaguo Yu , Liuyang Zhang . ZnO/D-A共轭聚合物S型异质结高效光催化产H₂O₂及其电荷转移动力学研究. Acta Physico-Chimica Sinica, 2024, 40(11): 2406027-. doi: 10.3866/PKU.WHXB202406027
12. [12]
  Yan Li , Xinze Wang , Xue Yao , Shouyun Yu . Kinetic Resolution Enabled by Photoexcited Chiral Copper Complex-Mediated Alkene E→Z Isomerization: A Comprehensive Chemistry Experiment for Undergraduate Students. University Chemistry, 2024, 39(5): 1-10. doi: 10.3866/PKU.DXHX202309053
13. [13]
  Ping ZHANG , Chenchen ZHAO , Xiaoyun CUI , Bing XIE , Yihan LIU , Haiyu LIN , Jiale ZHANG , Yu'nan CHEN . Preparation and adsorption-photocatalytic performance of ZnAl@layered double oxides. Chinese Journal of Inorganic Chemistry, 2024, 40(10): 1965-1974. doi: 10.11862/CJIC.20240014
14. [14]
  Peifeng Su , Xin Lu . Development of Undergraduate Quantum Mechanics Module in Chemistry Department under the “Double First Class” Initiative. University Chemistry, 2024, 39(8): 99-103. doi: 10.3866/PKU.DXHX202401087
15. [15]
  Rui Li , Jiayu Zhang , Anyang Li . Two Levels of Understanding of Chemical Bonds: a Case of the Bonding Model of Hypervalent Molecules. University Chemistry, 2024, 39(2): 392-398. doi: 10.3866/PKU.DXHX202308051
16. [16]
  Zhenlin Zhou , Siyuan Chen , Yi Liu , Chengguo Hu , Faqiong Zhao . A New Program of Voltammetry Experiment Teaching Based on Laser-Scribed Graphene Electrode. University Chemistry, 2024, 39(2): 358-370. doi: 10.3866/PKU.DXHX202308049
17. [17]
  Tianlong Zhang , Jiajun Zhou , Hongsheng Tang , Xiaohui Ning , Yan Li , Hua Li . Virtual Simulation Experiment for Laser-Induced Breakdown Spectroscopy (LIBS) Analysis. University Chemistry, 2024, 39(6): 295-302. doi: 10.3866/PKU.DXHX202312049
18. [18]
  Junke LIU , Kungui ZHENG , Wenjing SUN , Gaoyang BAI , Guodong BAI , Zuwei YIN , Yao ZHOU , Juntao LI . Preparation of modified high-nickel layered cathode with LiAlO₂/cyclopolyacrylonitrile dual-functional coating. Chinese Journal of Inorganic Chemistry, 2024, 40(8): 1461-1473. doi: 10.11862/CJIC.20240189
19. [19]
  Zian Lin , Yingxue Jin . Matrix-Assisted Laser Desorption/Ionization Mass Spectrometry (MALDI-MS) for Disease Marker Screening and Identification: A Comprehensive Experiment Teaching Reform in Instrumental Analysis. University Chemistry, 2024, 39(11): 327-334. doi: 10.12461/PKU.DXHX202403066
20. [20]
  Zitong Chen , Zipei Su , Jiangfeng Qian . Aromatic Alkali Metal Reagents: Structures, Properties and Applications. University Chemistry, 2024, 39(8): 149-162. doi: 10.3866/PKU.DXHX202311054

Get Citation

PDF

XML

Metrics

PDF Downloads(2553)
Abstract views(3038)
HTML views(6)

通讯作者: 陈斌, bchen63@163.com

1.
沈阳化工大学材料科学与工程学院沈阳 110142