User Tools

Site Tools


exercises:2017_ethz_mmm:mc_and_kmc

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

Both sides previous revisionPrevious revision
Next revision
Previous revision
Next revisionBoth sides next revision
exercises:2017_ethz_mmm:mc_and_kmc [2017/03/09 15:46] dpasseroneexercises:2017_ethz_mmm:mc_and_kmc [2017/03/10 16:21] dpasserone
Line 12: Line 12:
 <code> <code>
 you@eulerX ~$ wget http://www.cp2k.org/_media/exercises:2017_ethz_mmm:exercise_3.zip you@eulerX ~$ wget http://www.cp2k.org/_media/exercises:2017_ethz_mmm:exercise_3.zip
-you@eulerX ~$ unzip exercises:2017_ethz_mmm:e3_bis.zip+you@eulerX ~$ unzip exercises:2017_ethz_mmm:exercise_3.zip
 you@eulerX ~$ cd exercise_3 you@eulerX ~$ cd exercise_3
 </code> </code>
Line 59: Line 59:
 where k is Boltzmann's constant where k is Boltzmann's constant
 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 n0 use the average number of isolated molecules and of isolated diners that you have as output
 </note> </note>
  
Line 78: Line 79:
  
 <code> <code>
-#### 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