A single sentence description.
|Verification check of forces via numerical differentiation (Richardson extrapolation technique) v003|
|Description||Comparison of the analytical forces obtained from the model with forces computed by numerical differentiation using Richardson extrapolation for a randomly distorted non-periodic structure based off the equilibrium face-centered cubic (fcc) structure. Separate configurations are tested for each species supported by the model, as well as one containing a random distribution of all species. Configurations used for testing are provided as auxiliary files.|
A statement of applicability provided by the contributor, informing users of the intended use of this KIM Item.
This Verification Check is archived in OpenKIM [1-3].
 Verification check of forces via numerical differentiation (Richardson extrapolation technique) v003. OpenKIM; 2019. doi:10.25950/6ae3d5ed
 Tadmor EB, Elliott RS, Sethna JP, Miller RE, Becker CA. The potential of atomistic simulations and the Knowledgebase of Interatomic Models. JOM. 2011;63(7):17. doi:10.1007/s11837-011-0102-6
 Elliott RS, Tadmor EB. Knowledgebase of Interatomic Models (KIM) Application Programming Interface (API). OpenKIM; 2011. doi:10.25950/ff8f563aClick here to download the above citation in BibTeX format.
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|Extended KIM ID
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|KIM Item Type||Verification Check|
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