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Linear thermal expansion coefficient of cubic crystal structures v002
https://doi.org/10.25950/9d9822ec
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This Test Driver uses LAMMPS to compute the linear thermal expansion coefficient at a finite temperature under a given pressure for a cubic lattice (fcc, bcc, sc, diamond) of a single given species.
KIM ID:
TD_522633393614_002
Extended KIM ID:
LinearThermalExpansionCoeffCubic__TD_522633393614_002
Mingjian Wen
Brendon Waters
Mingjian Wen
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OpenKIM
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DOI registered
February 16, 2024
via DataCite
Software published 2024 in
Open Knowledgebase of Interatomic Models (OpenKIM)
Software