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cluster:175 [2018/09/25 12:35]
hmeij07
cluster:175 [2018/09/25 12:39]
hmeij07 [Lammps]
Line 70: Line 70:
 </code> </code>
  
-=== WZ ===+== Lammps (PMMA) == 
 + 
 +Material called PMMA (https://en.wikipedia.org/wiki/Poly(methyl_methacrylate). The PMMA simulations require the calculation of molecular bonds, which is not implemented in GPU hence more CPU cores are required than the Coillod example.
  
 a) 1GPU with X CPUs a) 1GPU with X CPUs
Line 90: Line 92:
 1 GTX GPU + 6 CPUs  90 ns/day 1 GTX GPU + 6 CPUs  90 ns/day
  
----- 
-Test dir location 
-/home/heme/work/lmp-wz 
  
  
--------------- 
-I am running a material called PMMA (https://en.wikipedia.org/wiki/Poly(methyl_methacrylate) ) 
  
-The reason for the different benchmark than yours is that the PMMA simulations require the calculation of molecular bonds, which is not implemented in GPU.  
  
 ==== Gromacs ==== ==== Gromacs ====
cluster/175.txt · Last modified: 2018/11/29 18:00 by hmeij07