{ "property-id" "tag:staff@noreply.openkim.org,2025-08-09:property/energy-and-crystal-structure-vs-hydrostatic-pressure-relation" "instance-id" 1 "disclaimer" "Relaxation failed to reach force tolerance of 1e-05 eV/angstrom at 3649.1211495028265 GPa, -2.5 GPa, -9.5 GPa, -51.0 GPa" "prototype-label" { "source-value" "AB4_tI10_87_a_h" } "stoichiometric-species" { "source-value" [ "C" "Fe" ] } "parameter-names" { "source-value" [ "c/a" "x2" "y2" ] } "crystal-genome-source-structure-id" { "source-value" [ [ "RD_805225375518_000" ] ] } "volume-per-atom" { "source-value" [ 23.053367807732876 20.744165210687434 20.585175008545473 20.466587963061635 20.368614690267606 20.283684239864463 20.20794436697708 20.139117116275496 20.075724946393212 20.0167441058621 19.96142947239876 19.909230487128795 19.859708874419905 19.812518416047592 19.767382742595974 19.724072891601885 19.68239737970143 19.642194415548264 19.60332580959296 19.565672100905662 19.529129273539514 19.49360597724384 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