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A single sentence description.
Broken-bond fit of high-symmetry surface energies in bcc Li
Description Computes the formation energy of several high-symmetry surfaces in bcc Li and uses them to fit a broken-bond model
The supported atomic species.
A short statement of applicability which will accompany any results computed using it. A developer can use the disclaimer to inform users of the intended use of this KIM Item.
Contributor mattbierbaum
Maintainer mattbierbaum
Author Matt Bierbaum
Publication Year 2018
Item Citation Click here to download a citation in BibTeX format.
Short KIM ID
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Extended KIM ID
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Citable Link https://openkim.org/cite/TE_567666532279_003
KIM Item TypeTest
Properties as defined in kimspec.edn. These properties are inhereted from the Test Driver.
KIM API Version2.0
Simulator Name
The name of the simulator as defined in kimspec.edn. This Simulator Name is inhereted from the Test Driver.
Programming Language(s)
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100.00% Python
Previous Version SurfaceEnergyCubicCrystalBrokenBondFit_bcc_Li__TE_567666532279_002
SurfaceEnergyCubicCrystalBrokenBondFit bcc Li TE_567666532279_003


Model Test Results Link to Test Results page Benchmark time
Usertime muliplied by the Whetstone Benchmark. This number can be used (approximately) to compare the performance of different models independently of the architecture on which the test was run.

Measured in Millions of Whetstone Instructions (MWI)
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 view 142580


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