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In our calculations, we used parameters calculated a-posteriori for each of the events (Table 1).
In our calculations, we used K=1.
For calculations we used the R software [14].
For our calculations, we used MATLAB (R2013b 8.2.0.701) software [50].
In the molecular mechanics part of the calculations, we used CHARMM force field version 36.
For the volume calculations we used expression (6) with the molar volumes listed in Table 2.
For sample size calculations we used GLIMMPSE (Kreidler et al. [12]).
For the calculations, we used the materials parameters reported in Ref. [24] for GaAs and Al0.3Ga0.7As.
For the calculations, we used 9090 time steps at time intervals of 0.022 s.
Concerning calculations, we used the Amsterdam Density Functional (ADF) quantum chemistry package [26, 27].
In the calculations, we used a 300-nm GMN layer buried at 150-nm depth.
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