2013 年 34 巻 7 号 p. 340-345
‘SurfSeg’ is a simulation software that predicts surface segregation behavior of an under-layer element in layered materials, which was developed by the author. After briefly introducing the principle of the prediction, the accuracy is discussed based on the approximation used for the prediction. Then, appropriate conditions for utilizing the simulation is discussed from a viewpoint of comparing simulated results with experimental results.