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exercises:2015_ethz_mmm:index [2015/02/12 13:38] – [Brutus Cheat Sheet] oschuettexercises:2015_ethz_mmm:index [2020/08/21 10:15] (current) – external edit 127.0.0.1
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   - [[nudged_elastic_band|Nudged Elastic Band]]   - [[nudged_elastic_band|Nudged Elastic Band]]
  
-===== Lecture 2 (tentative) =====+===== Lecture 2 =====
   - [[c2h2_bond_energy|Bond Strength in a molecule]]   - [[c2h2_bond_energy|Bond Strength in a molecule]]
   - [[alanine_dipeptide|Alanine dipeptide: Ramachandran plot]]   - [[alanine_dipeptide|Alanine dipeptide: Ramachandran plot]]
   - [[alanine_modify|Alanine dipeptide: Modifying the parameters of the force field]]   - [[alanine_modify|Alanine dipeptide: Modifying the parameters of the force field]]
  
-===== Lecture 3 (tentative) =====+===== Lecture 3 =====
   - [[surface_Cu|surface energy of Cu(111), Cu(110), Cu(100) and Wulff plot]]   - [[surface_Cu|surface energy of Cu(111), Cu(110), Cu(100) and Wulff plot]]
   - [[surface_Au|surface energy of Au(110): perfect and reconstructed and other faces]]   - [[surface_Au|surface energy of Au(110): perfect and reconstructed and other faces]]
  
-===== Lecture 4 (tentative) =====+===== Lecture 4 =====
   - [[MD_ala|Molecular dynamics of alanine dipeptide]]   - [[MD_ala|Molecular dynamics of alanine dipeptide]]
   - [[MD_slab|Molecular dynamics of Au 100 slab]]   - [[MD_slab|Molecular dynamics of Au 100 slab]]
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 you@eulerX ~$ bjobs you@eulerX ~$ bjobs
 JOBID      USER    STAT  QUEUE      FROM_HOST   EXEC_HOST   JOB_NAME   SUBMIT_TIME JOBID      USER    STAT  QUEUE      FROM_HOST   EXEC_HOST   JOB_NAME   SUBMIT_TIME
-2954976    you     PEND  beta.4h    euler02                 hostname Feb 12 14:07 +2955028    you     PEND  beta.4h    euler02                 *nergy.out Feb 12 14:21 
-you@eulerX ~$ bkill 2954976 +you@eulerX ~$ bkill 2955028 
-Job <2954976> is being terminated+Job <2955028> is being terminated
 </code> </code>
  
exercises/2015_ethz_mmm/index.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1