Supporting data for [Temperature effects in the initial stages of heteroepitaxial film growth]
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This data set contains the data for the article with the same title which will be submitted to the journal Surfaces (MDPI) in September 2021 by Tung B. T. To and Fabio D. A. Aarao Reis. In the following data files, the first column is the thickness d and the second column is the roughness W as shown in Figure 3(a) and Figure 5, and Figure 8. w_mean[y].dat, where [y] is the name of the parameter set listed in Table 1. In the following data files, the first column is the lattice distance s and the second column is the value of the autocorrelation function \Gamma as shown in Figure 3(b), Figure 7. gamma_meant[x][y].dat, where [x] is the film thickness and [y] is the name of the parameter set listed in Table 1. The following data files show the height profiles of the film for one simulation realization of a given parameter set as shown in Figures 2, 4, 6. fileht[x][y].dat, where [x] is the film thickness and [y] is the name of the parameter set listed in Table 1. These files can be read as follows. fileh = fopen("fileht[x][y].dat", "r"); for (i=0; i<1024; i++){ for (j=0; j<1024; j++){ fscanf(fileh, "%d\n", &htemp); h[i][j]=htemp; } } fclose(fileh); The file substrate_covering.txt shows the mean film thickness in which the first layer (z=1) is occupied by 99% (theta_c). The first column shows the parameter set as listed in Table 1. The second column shows the mean film thickness in which the first layer (z=1) is occupied by 99% as shown in Figures 3(a) and 5.
本数据集包含2021年9月将提交至MDPI旗下期刊《Surfaces》的同名学术论文的配套数据,作者为Tung B. T. To与Fabio D. A. Aarao Reis。 下述w_mean[y].dat数据文件中,[y]为表1所列参数集的名称。此类文件的第一列为厚度d,第二列为粗糙度W,对应图3(a)、图5及图8的结果。 下述gamma_meant[x][y].dat数据文件中,[x]为薄膜厚度,[y]为表1所列参数集的名称。此类文件的第一列为晶格间距s,第二列为自相关函数Γ的数值,对应图3(b)与图7的结果。 下述fileht[x][y].dat数据文件中,[x]为薄膜厚度,[y]为表1所列参数集的名称。此类文件存储了给定参数集单次模拟实现对应的薄膜高度分布,对应图2、图4、图6的结果。其读取代码如下: fileh = fopen("fileht[x][y].dat", "r"); for (i=0; i<1024; i++){ for (j=0; j<1024; j++){ fscanf(fileh, "%d ", &htemp); h[i][j]=htemp; } } fclose(fileh); 文件substrate_covering.txt记录了第一原子层(z=1)占据率达99%(记为θ_c)时的平均薄膜厚度。该文件第一列为表1所列的参数集名称,第二列为第一原子层占据率达99%时的平均薄膜厚度,对应图3(a)与图5的结果。




