potfit wiki

open source force-matching

User Tools

Site Tools

parameters

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
Last revisionBoth sides next revision
parameters [2019/01/27 10:19] – danielparameters [2019/02/23 09:57] – daniel
Line 149: Line 149:
 | mixing parameter for dipole convergence during iteration. ||| | mixing parameter for dipole convergence during iteration. |||
  
 +====  parameters for OpenKIM potentials  ====
 +
 +The options for OpenKIM potentials are described in more detail on the [[models:openkim|OpenKIM]] page.
 +
 +|<100% 33% 33% 33%>|
 +^ **kim_model_name** | string | (none) |
 +| KIM model indentifier |||
 +
 +|<100% 33% 33% 33%>|
 +^ **kim_model_params** | string | (none) |
 +| Special parameter option, see [[models:openkim|OpenKIM]] page for details |||
 +
 +|<100% 33% 33% 33%>|
 +^ **kim_model_output_directory** | string | (none) |
 +| Output directory for the optimized KIM model |||
 +
 +|<100% 33% 33% 33%>|
 +^ **kim_model_output_name** | string | (none) |
 +| Name for the optimized KIM model |||
parameters.txt · Last modified: 2019/08/11 12:11 by daniel