exercises:2017_ethz_mmm:mc_and_kmc
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exercises:2017_ethz_mmm:mc_and_kmc [2017/03/09 15:05] – dpasserone | exercises:2017_ethz_mmm:mc_and_kmc [2020/08/21 10:15] (current) – external edit 127.0.0.1 | ||
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<note tip> | <note tip> | ||
- | All files of this exercise be downloaded from the wiki: {{e3_bis.zip|}} | + | All files of this exercise |
Download the exercise into your $HOME folder and unzip it. | Download the exercise into your $HOME folder and unzip it. | ||
< | < | ||
- | you@eulerX ~$ wget http:// | + | you@eulerX ~$ wget http:// |
- | you@eulerX ~$ unzip exercises: | + | you@eulerX ~$ unzip exercises: |
you@eulerX ~$ cd exercise_3 | you@eulerX ~$ cd exercise_3 | ||
</ | </ | ||
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on the left panel. | on the left panel. | ||
- | {{: | + | {{: |
In the central panel average values for the number of isolated molecules, the number of dimers and the number of clusters | In the central panel average values for the number of isolated molecules, the number of dimers and the number of clusters | ||
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where k is Boltzmann' | where k is Boltzmann' | ||
T is the simulation (and experiment) temperature | T is the simulation (and experiment) temperature | ||
- | n0 is teh concentration of dimers in the case of zero interaction | + | n0 is the concentration of dimers in the case of zero interaction |
nexp is the concentration of dimers found in the experiment | nexp is the concentration of dimers found in the experiment | ||
+ | To compute the concentration consider that at coverage 0.02, in the simulation, the total number of molecules is 50 | ||
</ | </ | ||
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< | < | ||
- | #### MAIN MC LOOP | + | clusters_plot=[] |
+ | for i in range(nouter): | ||
and also the section | and also the section |
exercises/2017_ethz_mmm/mc_and_kmc.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1