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LAMMPS ReaxFF potential for Li-S systems developed by Islam et al. (2014) v000
https://doi.org/10.25950/75cc244d
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This is a ReaxFF parametrization intended to study the structural, mechanical, and kinetic behavior of the amorphous lithiated sulfur (a-LixS) compounds.
KIM ID:
SM_058492438145_000
Extended KIM ID:
Sim_LAMMPS_ReaxFF_IslamOstadhosseinBorodin_2015_LiS__SM_058492438145_000
Mahbub Islam
Alireza Ostadhossein
Oleg Borodin
Alan Yeates
Will Tipton
Richard Hennig
Nitin Kumar
Adri van Duin
I Nikiforov
Other
OpenKIM
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DOI registered
November 9, 2022
via DataCite
Software published 2022 in
Open Knowledgebase of Interatomic Models (OpenKIM)
Software