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EAM_Magnetic2GQuintic__MD_543355979582_002

Title
A single sentence description.
Second generation EAM potential within the magnetic potential formalism with quintic interpolation v002
Description Second generation EAM potential within the magnetic potential formalism of Dudarev and Derlet (2005). Quintic spline interpolation is used for the repulsive and pair density terms.
Disclaimer
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None
Contributor markgilbert
Maintainer markgilbert
Creator Mark R. Gilbert
Publication Year 2018
Item Citation

This Model Driver originally published in [1] is archived in OpenKIM [2-4].

[1] Chiesa S, Derlet PM, Dudarev SL, Swygenhoven HV. Optimization of the magnetic potential for α-Fe. Journal of Physics: Condensed Matter. 2011;23(20):206001. doi:10.1088/0953-8984/23/20/206001

[2] Second generation EAM potential within the magnetic potential formalism with quintic interpolation v002. OpenKIM; 2018. doi:10.25950/ed3ceac9

[3] 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

[4] Elliott RS, Tadmor EB. Knowledgebase of Interatomic Models (KIM) Application Programming Interface (API). OpenKIM; 2011. doi:10.25950/ff8f563a

Click here to download the above citation in BibTeX format.
Funding Not available
Short KIM ID
The unique KIM identifier code.
MD_543355979582_002
Extended KIM ID
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EAM_Magnetic2GQuintic__MD_543355979582_002
DOI 10.25950/ed3ceac9
https://doi.org/10.25950/ed3ceac9
https://search.datacite.org/works/10.25950/ed3ceac9
KIM Item TypeModel Driver
KIM API Version2.0
Programming Language(s)
The programming languages used in the code and the percentage of the code written in each one.
100.00% Fortran
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