2009, Vol. 26(7): 76801-076801 DOI: 10.1088/0256-307X/26/7/076801 | ||
Density Functional Calculation of the 0.5ML-Terminated Allyl Mercaptan/Si(100)-(2×1) Surface | ||
TANG Chun-Mei1,2, DENG Kai-Ming1,2, CHEN Xuan1,2, XIAO Chuan-Yun1,2, LIU Yu-Zhen1,2, LI Qun-Xiang2 | ||
1Department of Applied Physics, Nanjing University of Science and Technology, Nanjing 2100942Hefei National Laboratory for Physical Sciences at the Microscale, University of Science and Technology of China, Hefei 230026 | ||
收稿日期 2009-02-06 修回日期 1900-01-01 | ||
Supporting info | ||
[1] Masri P 2002 Surf. Sci. Rep. 48 1 [2] Bent S F 2002 J. Phys. Chem. B 106 2830 [3] Bent S F 2002 Surf. Sci. 500 879 [4] Basu R, Guisinger N P, Greene M E and Hersam M C 2004 [5] Wolkow R A 1999 Annu. Rev. Phys. Chem. 50 413 [6] Okawa Y and Aono M 2001 J. Chem. Phys. 115 [7] Kruse P, Johnson E R, DiLabio G A and Wolkow R A 2002 [8] Hossain M Z, Kato H S and Kawai M 2005 J. Am. Chem. [9] Lopinski G P, Wayner D D M and Wolkow R A 2000 [10] Kohn W and Sham L J 1965 Phys. Rev. 140 A1133 [11] Wang X C, Zhang J H, Wen Y H and Zhu Z Z 2009 Chin. [12] Bl\"{ochl P E 1994 Phys. Rev. B 50 17953 [13] Pei X Y, Yang X P and Dong J M 2006 Phys. Rev. B [14] Perdew J P, Burke K and Ernzerhof M 1996 Phys. Rev. [15] \^{Stich I, Car R, Parrinello M and Baroni S 1989 [16] Nicolay G, Reinert F, H\"{ufner S and Blaha P 2001 [17] Kr\'{cmar M and Fu C L 2003 Phys. Rev. B 68 [18] Errico L A, Fabricius G, Renter\'{la M, Presa P D L and [19] Kresse G and Joubert D 1999 Phys. Rev. B 59 [20] Kr\"{uger P and Pollmann J 1993 Phys. Rev. B [21] Ciston J, Marks L D, Feidenhans R, Bunk O, Falkenbergand [22] Romero A H, Sbraccia C and Silvestrelli P L 2004 J. [23] Droogenbroeck J V, Tersago K, Alsenoy C V and Blockhuys F [24] Cakmak M and Srivastava G P 1999 Phys. Rev. B [25] Orita H and Naotsugu I 2004 Surf. Sci 550 177 [26] Preuss M, Schmidt W G and Bechstedt F 2004 J. Phys. [27] Hortamani M, Wu H, Kratzer P and Scheffler M 2006 |
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