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tersoff [2013/08/08 15:46] – footnote danielinteractions:tersoff [2018/01/06 10:39] (current) – ↷ Page moved from tersoff to interactions:tersoff daniel
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 ~~NOTOC~~ ~~NOTOC~~
 ====== Tersoff Potentials ====== ====== Tersoff Potentials ======
----- 
- 
-<WRAP round alert> 
-Tersoff potentials are currently only available in the manybody branch of the git repository! 
-They are not part of the latest release package. 
-</WRAP> 
  
 ---- ----
Line 73: Line 67:
  
 ==== IMD output ==== ==== IMD output ====
 +
 +An analytic IMD potential which can be used with the ''tersoff2'' option of IMD is written to ''*.imd.tersoff.pot''.
 +This file, however, may not be used as a potential file for IMD. Instead, its contents need to be copied
 +INTO the IMD parameter file.
  
 ==== LAMMPS output ==== ==== LAMMPS output ====
 +
 +The potential can also be written in LAMMPS format. The name of the output file is ''*.lammps.tersoff''
  
interactions/tersoff.1375969597.txt.gz · Last modified: 2013/08/08 15:46 by daniel