Multimillion-atom molecular dynamics simulation of atomic level stresses in Si(111)/Si3N4(0001) nanopixels

被引:37
作者
Bachlechner, ME [1 ]
Omeltchenko, A
Nakano, A
Kalia, RK
Vashishta, P
Ebbsjo, I
Madhukar, A
Messina, P
机构
[1] Louisiana State Univ, Dept Phys & Astron, Concurrent Comp Lab Mat Simulat, Baton Rouge, LA 70803 USA
[2] Louisiana State Univ, Dept Comp Sci, Baton Rouge, LA 70803 USA
[3] Uppsala Univ, Studsvik Neutron Res Lab, S-61182 Nykoping, Sweden
[4] Univ So Calif, Dept Mat Sci & Engn, Los Angeles, CA 90089 USA
[5] CALTECH, Ctr Adv Comp Res, Pasadena, CA 91125 USA
关键词
D O I
10.1063/1.121237
中图分类号
O59 [应用物理学];
学科分类号
摘要
Ten million atom multiresolution molecular-dynamics simulations are performed on parallel computers to determine atomic-level stress distributions in a 54 nm nanopixel on a 0.1 mu m silicon substrate. Effects of surfaces, edges, and lattice mismatch at the Si(111)/Si3N4(0001) interface on the stress distributions are investigated. Stresses are found to be highly inhomogeneous in the nanopixel. The top surface of silicon nitride has a compressive stress of + 3 GPa and the stress is tensile, -1 GPa, in silicon below the interface. (C) 1998 American Institute of Physics.
引用
收藏
页码:1969 / 1971
页数:3
相关论文
共 22 条
[1]  
Bachlechner ME, 1997, MATER RES SOC SYMP P, V446, P157
[2]   Environment-dependent interatomic potential for bulk silicon [J].
Bazant, MZ ;
Kaxiras, E ;
Justo, JF .
PHYSICAL REVIEW B, 1997, 56 (14) :8542-8552
[3]   TRANSITION FROM METALLIC TO COVALENT STRUCTURES IN SILICON CLUSTERS [J].
CHELIKOWSKY, JR .
PHYSICAL REVIEW LETTERS, 1988, 60 (25) :2669-2672
[4]   COMPARISON OF SEMIEMPIRICAL POTENTIAL FUNCTIONS FOR SILICON AND GERMANIUM [J].
COOK, SJ ;
CLANCY, P .
PHYSICAL REVIEW B, 1993, 47 (13) :7686-7699
[5]   MICRO-RAMAN STUDY OF STRESS-DISTRIBUTION IN LOCAL ISOLATION STRUCTURES AND CORRELATION WITH TRANSMISSION ELECTRON-MICROSCOPY [J].
DEWOLF, I ;
VANHELLEMONT, J ;
ROMANORODRIGUEZ, A ;
NORSTROM, H ;
MAES, HE .
JOURNAL OF APPLIED PHYSICS, 1992, 71 (02) :898-906
[6]  
Ferry DK, 1997, TRANSPORT NANOSTRUCT
[7]   EDGE-INDUCED STRESS AND STRAIN IN STRIPE FILMS AND SUBSTRATES - A 2-DIMENSIONAL FINITE-ELEMENT CALCULATION [J].
JAIN, SC ;
HARKER, AH ;
ATKINSON, A ;
PINARDI, K .
JOURNAL OF APPLIED PHYSICS, 1995, 78 (03) :1630-1637
[8]   Morphology of pores and interfaces and mechanical behavior of nanocluster-assembled silicon nitride ceramic [J].
Kalia, RK ;
Nakano, A ;
Tsuruta, K ;
Vashishta, P .
PHYSICAL REVIEW LETTERS, 1997, 78 (04) :689-692
[9]   COHERENT PRECIPITATION OF SILICON-NITRIDE IN SILICON [J].
KAUSHIK, VS ;
DATYE, AK ;
KENDALL, DL ;
MARTINEZTOVAR, B ;
MYERS, DR .
APPLIED PHYSICS LETTERS, 1988, 52 (21) :1782-1784
[10]   Effect of strain on structure and morphology of ultrathin Ge films on Si(001) [J].
Liu, F ;
Wu, F ;
Lagally, MG .
CHEMICAL REVIEWS, 1997, 97 (04) :1045-1061