Physics – Condensed Matter – Materials Science
Scientific paper
2004-08-11
Surface Science 573, L375 - L381 (2004)
Physics
Condensed Matter
Materials Science
4 figures, 1 table
Scientific paper
10.1016/j.susc.2004.09.041
In this article we show that the reconstructions of semiconductor surfaces can be determined using a genetic procedure. Coupled with highly optimized interatomic potentials, the present approach represents an efficient tool for finding and sorting good structural candidates for further electronic structure calculations and comparison with scanning tunnelling microscope (STM) images. We illustrate the method for the case of Si(105), and build a database of structures that includes the previously found low-energy models, as well as a number of novel configurations.
Chuang Frank C.
Ciobanu Cristian V.
Ho Kai-Ming
Shenoy Vijay B.
Wang Cai-Zhuang
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