Please wait a minute...
Acta Metall Sin  2009, Vol. 45 Issue (2): 211-216    DOI:
论文 Current Issue | Archive | Adv Search |
MOLECULAR DYNAMICS SIMULATION OF DEPOSITING LOW–ENERGY ATOM Ti ON Ti(0001) SURFACE
HUANG He 1; YAN Chao 2; LAI Xinchun 1; LIU Tianwei 1; ZHANG Qingyu 2
1. China Academy of Engineering Physics; Mianyang 621700
2. State Key Laboratory of Materials Modification by Laser; Ion and Electron Beams; Dalian University of Technology;Dalian 116204
Cite this article: 

HUANG He YAN Chao LAI Xinchun LIU Tianwei ZHANG Qingyu. MOLECULAR DYNAMICS SIMULATION OF DEPOSITING LOW–ENERGY ATOM Ti ON Ti(0001) SURFACE. Acta Metall Sin, 2009, 45(2): 211-216.

Download:  PDF(6271KB) 
Export:  BibTeX | EndNote (RIS)      
Abstract  

Molecular dynamics (MD) with embedded atom method (EAM) was used for describing the variations of adsorption, sputtering and vacancy on surface with energy of incident atom Ti.The results show that a sputtering threshold energy of about 40—50 eV exists in the deposited process, and the incident atom with energy below the threshold value can be thought as deposited atom. Otherwise,the sputtering yield increases linearly with the increase of incident energy. Both distributions of adsorption and sputtering atoms present a 6–rotational symmetry. Adatoms mostly come from surface atoms of the substrate when incident energy is above threshold value, and the probability of incident atoms becoming adatoms is very little. Vacancies distribute mainly on the 1st layer and their amount in the sub–layer increases with the increase of incident energy which is above threshold value.

Key words:  molecular dynamics (MD)      embedded atom method (EAM)      sputtering      adsorption      vacancy     
Received:  07 July 2008     
ZTFLH: 

O562.4

 
Fund: 

Supported by NSFC–NSAF (No.10476003)

URL: 

https://www.ams.org.cn/EN/     OR     https://www.ams.org.cn/EN/Y2009/V45/I2/211

[1] Li D J, Zhang J J, Cao M. Mater Lett, 2007; 61: 4344
[2] Meng L J, Gao J S, Silva R A, Song S G. Thin Solid Films, 2008; 516: 5454
[3] Oehme M, Werner J, Kirfel O, Kasper E. Appl Surf Sci, 2008; 254: 6238
[4] Venkatachalam S, Lida Y, Kanno Y. Superlattices Micostruct, 2008; 44: 127
[5] Wihelmsson O, Eklund P, H¨ogberg H, Hultman L, Jansson U. Acta Mater, 2008; 56: 2563
[6] Guzman L, Wolf G K, Davies G M. Surf Coat Technol, 2004; 174–175: 158
[7] Schwarz G, Friess F, Wolf G K. Surf Coat Technol, 2000;125: 106
[8] Webb R P, Harrison D E Jr. Radiat Eff Lett, 1983; 86: 15
[9] Michely T, Teichert C. Phys Rev, 1994; 50B: 11156
[10] Villarba M, J´onsson H. Surf Sci, 1995; 324: 35
[11] Esch S, Breeman M, Morgenstern M, Michely T, Comsa G. Surf Sci, 1996; 365: 187
[12] Zhang Q Y, Pan Z Y, Tang J Y. Acta Phys Sin, 1999; 8:296
[13] Daw M S, Baskes M I. Phys Rev Lett, 1983; 50: 1285
[14] Daw M S, Baskes M I. Phys Rev, 1984; 29B: 6443
[15] Nelson J S, Daw M S, Sowa E C. Phys Rev, 1989; 40B:1465
[16] Foiles S M, Baskes M I, Daw M S. Phys Rev, 1986; 33B:7983
[17] Wright A F, Daw M S, Fong C Y. Phys Rev, 1990; 42B:9409
[18] Fallis M C, Daw M S, Fong C Y. Phys Rev, 1995; 51B:7817
[19] Zhou X W, Johson R A, Wadley H N G. Phys Rev, 2004;69B: 144113
[20] Steinbr¨uchel Ch. Appl Phys, 1985; 36A: 37
[21] Sigmund P. Phys Rev, 1969; 184: 383
[22] Laegreid N, Wehner G K. Appl Phys, 1961; 32: 365
[23] Whetten T J, Armstead A A, Grzybowski T A. J Vac Sci Technol, 1984; 2: 477
[24] Abrams C F, Graves D B. Appl Phys, 1999; 86: 2263

[1] HUANG Ding, QIAO Yanxin, YANG Lanlan, WANG Jinlong, CHEN Minghui, ZHU Shenglong, WANG Fuhui. Effect of Shot Peening of Substrate Surface on Cyclic Oxidation Behavior of Sputtered Nanocrystalline Coating[J]. 金属学报, 2023, 59(5): 668-678.
[2] LIAO Jingjing, ZHANG Wei, ZHANG Junsong, WU Jun, YANG Zhongbo, PENG Qian, QIU Shaoyu. Periodic Densification-Transition Behavior of Zr-Sn-Nb-Fe-V Alloys During Uniform Corrosion in Superheated Steam[J]. 金属学报, 2023, 59(2): 289-296.
[3] CAO Qingping, LV Linbo, WANG Xiaodong, JIANG Jianzhong. Magnetron Sputtering Metal Glass Film Preparation and the “Specimen Size Effect” of the Mechanical Property[J]. 金属学报, 2021, 57(4): 473-490.
[4] WANG Xuemei, YIN Zhengzheng, YU Xiaotong, ZOU Yuhong, ZENG Rongchang. Comparison of Corrosion Resistance of Phenylalanine, Methionine, and Asparagine-Induced Ca-P Coatings on AZ31 Magnesium Alloys[J]. 金属学报, 2021, 57(10): 1258-1271.
[5] WANG Luning, LIU Lijun, YAN Yu, YANG Kun, LU Lili. Influences of Protein Adsorption on the in vitro Corrosion of Biomedical Metals[J]. 金属学报, 2021, 57(1): 1-15.
[6] CAO Fengting, WEI Jie, DONG Junhua, KE Wei, WANG Tiegang, FAN Qixiang. Corrosion Inhibition Behavior of 1-Hydroxyethylidene-1, 1-Diphosphonic Acid on 20SiMn Steel in Simulated Concrete Pore Solution Containing Cl-[J]. 金属学报, 2020, 56(6): 898-908.
[7] GAO Xiang, ZHANG Guikai, XIANG Xin, LUO Lizhu, WANG Xiaolin. Effects of Alloying Elements on the Adsorption of Oxygen on V(110) Surfaces: A First-Principles Study[J]. 金属学报, 2020, 56(6): 919-928.
[8] MA Xiaoqiang,YANG Kunjie,XU Yuqiong,DU Xiaochao,ZHOU Jianjun,XIAO Renzheng. Molecular Dynamics Simulation of DisplacementCascades in Nb[J]. 金属学报, 2020, 56(2): 249-256.
[9] LIU Yanmei, WANG Tiegang, GUO Yuyao, KE Peiling, MENG Deqiang, ZHANG Jifu. Design, Preparation and Properties of Ti-B-N Nanocomposite Coatings[J]. 金属学报, 2020, 56(11): 1521-1529.
[10] Mengwei CAO,Tao CAI,Xia ZHANG. Study on Amination Modification of Fe-BTC and Their Adsorption for Dyes and Heavy Metal Ions[J]. 金属学报, 2019, 55(7): 821-830.
[11] Wentao LI,Zhenyu WANG,Dong ZHANG,Jianguo PAN,Peiling KE,Aiying WANG. Preparation of Ti2AlC Coating by the Combination of a Hybrid Cathode Arc/Magnetron Sputtering with Post-Annealing[J]. 金属学报, 2019, 55(5): 647-656.
[12] Shasha YANG,Feng YANG,Minghui CHEN,Yunsong NIU,Shenglong ZHU,Fuhui WANG. Effect of Nitrogen Doping on Microstructure and Wear Resistance of Tantalum Coatings Deposited by Direct Current Magnetron Sputtering[J]. 金属学报, 2019, 55(3): 308-316.
[13] Houpu WU,Xiubo TIAN,Xinyu ZHANG,Chunzhi GONG. Discharge Characteristics of Novel Dual-Pulse HiPIMS and Deposition of CrN Films with High Deposition Rate[J]. 金属学报, 2019, 55(3): 299-307.
[14] Xiaoqin MA, Qingfeng ZHAN, Jincai LI, Qingfang LIU, Baomin WANG, Runwei LI. Influence of Oblique Sputtering on Stripe Magnetic Domain Structure and Magnetic Anisotropy of CoFeB Thin Films[J]. 金属学报, 2018, 54(9): 1281-1288.
[15] Shuaipeng WANG, Wenhua LUO, Gan LI, Haibo LI, Guangfeng ZHANG. Effect of La Content on Hydriding Kinetics of Ce-La Alloys[J]. 金属学报, 2018, 54(8): 1187-1192.
No Suggested Reading articles found!