A single sentence description.
|Stillinger-Weber (SW) Model Driver v004|
|Description||This is a model driver for the generalized Stillinger-Weber (SW) three-body potential supporting multiple species.|
A statement of applicability provided by the contributor, informing users of the intended use of this KIM Item.
|Published on KIM||2018|
|How to Cite||Click here to download this citation in BibTeX format.|
|Short KIM ID
The unique KIM identifier code.
|Extended KIM ID
The long form of the KIM ID including a human readable prefix (100 characters max), two underscores, and the Short KIM ID. Extended KIM IDs can only contain alpha-numeric characters (letters and digits) and underscores and must begin with a letter.
|KIM Item Type||Model Driver|
|KIM API Version||2.0.2|
|Simulator Potential Compatibility||
LAMMPS : sw — partial
This driver is consistent with 'pair_style sw' in the LAMMPS package, but the parameter file has a different format and the driver is less general than the LAMMPS implementation. Specifically, in the KIM parameter file, only independent pairwise parameters are read in and the three-body parameters are generated through geometric averaging. In addition, the costheta_0 parameter is assumed to be the same for all three-body interactions and the tolerance parameter introduced in LAMMPS for efficiency is not supported. See the README file for details. A Python utility "lammps_sw_2_kim_sw.py" is provided to translate LAMMPS 'pair_style sw' parameter files to the KIM model driver format.
The programming languages used in the code and the percentage of the code written in each one.
|SW__MD_335816936951_004.txz||Tar+XZ||Linux and OS X archive|