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StackingFaultFccCrystal_Kr_0bar__TE_921811007024_000

Title
A single sentence description.
Stacking and twinning fault energies for fcc Kr
Description Intrinsic and extrinsic stacking fault energies, unstable stacking fault energy, unstable twinning energy, stacking fault energy as a function of fractional displacement, and gamma surface for fcc Kr at zero temperature and pressure.
Species
The supported atomic species.
Kr
Disclaimer
A statement of applicability provided by the contributor, informing users of the intended use of this KIM Item.
None
Contributor Subrahmanyam Pattamatta
Maintainer Subrahmanyam Pattamatta
Publication Year 2018
Item Citation Click here to download this citation in BibTeX format.
Funding Not available
Short KIM ID
The unique KIM identifier code.
TE_921811007024_000
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.
StackingFaultFccCrystal_Kr_0bar__TE_921811007024_000
Citable Link https://openkim.org/cite/TE_921811007024_000
KIM Item TypeTest
DriverStackingFaultFccCrystal__TD_228501831190_000
Properties
Properties as defined in kimspec.edn. These properties are inhereted from the Test Driver.
KIM API Version1.9.0
Simulator Name
The name of the simulator as defined in kimspec.edn. This Simulator Name is inhereted from the Test Driver.
lammps
Programming Language(s)
The programming languages used in the code and the percentage of the code written in each one.
100.00% Python


Models

LennardJones612__MD_414112407348_002
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)
LennardJones612_UniversalShifted__MO_959249795837_002 view 8609053
Pair_Lennard_Jones_Shifted__MD_498634107543_002
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)
Pair_Lennard_Jones_Shifted_Bernardes_HighCutoff_Kr__MO_923895531627_002 view 132250750
Pair_Lennard_Jones_Shifted_Bernardes_LowCutoff_Kr__MO_995724792024_002 view 13942123
Pair_Lennard_Jones_Shifted_Bernardes_MedCutoff_Kr__MO_984281096460_002 view 48745516


Errors

  • No Errors associated with this Test




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StackingFaultFccCrystal__TD_228501831190_000.txz Tar+XZ Linux and OS X archive
StackingFaultFccCrystal__TD_228501831190_000.zip Zip Windows archive

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