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exercises:2015_ethz_mmm:c2h2_bond_energy [2015/03/06 02:39] dpasseroneexercises:2015_ethz_mmm:c2h2_bond_energy [2015/03/13 15:25] dpasserone
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 ====== C2H2 and C2H4 bond energy ====== ====== C2H2 and C2H4 bond energy ======
-<note warning> 
 <note warning> <note warning>
 TO USE THE FUNCTION LIBRARY (VERSION UP TO DATE) IN THE INTERACTIVE SHELL: TO USE THE FUNCTION LIBRARY (VERSION UP TO DATE) IN THE INTERACTIVE SHELL:
-you@eulerX ~$ module load courses mmm mmm-init+ 
 +you@eulerX ~$ module load courses mmm vmd 
 +  
 +you@eulerX ~$ mmm-init
 </note> </note>
  
-<note warning> 
-Before you start it is **ABSOLUTELY NEСESSARY** to update the function library. So from you $HOME directory please run: 
-<code> 
-you@eulerX ~$ ./update_functionlibrary 
-</code> 
-** Pay attention to the output of this program. It may give you some helpful information** 
  
-If you don't have the file "update_functionlibrary" please download it from here {{update_functionlibrary.zip|}} and unzip into your $HOME directory 
-<code> 
-you@eulerX ~$ unzip update_functionlibrary.zip 
-you@eulerX ~$ chmod 755 update_functionlibrary 
-</code> 
-Or if you are working on the remote computer you can also do the following: 
-<code> 
-you@eulerX ~$ wget http://www.cp2k.org/_media/exercises:2015_ethz_mmm:update_functionlibrary.zip 
-you@eulerX ~$ unzip exercises:2015_ethz_mmm:update_functionlibrary.zip 
-you@eulerX ~$ chmod 755 update_functionlibrary 
-</code> 
- 
-</note> 
  
 <note important> **REMEMBER: this is the command to load the  module for the cp2k program:** <note important> **REMEMBER: this is the command to load the  module for the cp2k program:**
exercises/2015_ethz_mmm/c2h2_bond_energy.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1