[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A6B6C_oP52_62_2c2d_2c2d_c" } "stoichiometric-species" { "source-value" [ "C" "O" "V" ] } "a" { "source-value" 7.6111 "source-unit" "angstrom" "si-unit" "m" "si-value" 7.611100000000001e-10 } "binding-potential-energy-per-atom" { "source-value" -37.09647719080551 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.943510895882254e-18 } "binding-potential-energy-per-formula" { "source-value" -482.25420348047163 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.72656416464693e-17 } "parameter-names" { "source-value" [ "b/a" "c/a" "x1" "z1" "x2" "z2" "x3" "z3" "x4" "z4" "x5" "z5" "x6" "y6" "z6" "x7" "y7" "z7" "x8" "y8" "z8" "x9" "y9" "z9" ] } "parameter-values" { "source-value" [ 0.73198355 0.52135697 0.21708434 0.34883622 0.8760377 0.54789961 0.3953803 0.29101118 0.042793964 0.37967612 0.099963761 0.87372278 0.82838452 0.10599147 0.94451665 0.85590797 0.98591939 0.62301873 0.96357039 0.057097475 0.36733416 0.79627068 0.069113276 0.31738433 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A6B6C_oP52_62_2c2d_2c2d_c" } "stoichiometric-species" { "source-value" [ "C" "O" "V" ] } "a" { "source-value" 7.6111 "source-unit" "angstrom" "si-unit" "m" "si-value" 7.611100000000001e-10 } "cell-cauchy-stress" { "source-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-unit" "eV/angstrom^3" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "temperature" { "source-value" 0.0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "parameter-names" { "source-value" [ "b/a" "c/a" "x1" "z1" "x2" "z2" "x3" "z3" "x4" "z4" "x5" "z5" "x6" "y6" "z6" "x7" "y7" "z7" "x8" "y8" "z8" "x9" "y9" "z9" ] } "parameter-values" { "source-value" [ 0.73198355 0.52135697 0.21708434 0.34883622 0.8760377 0.54789961 0.3953803 0.29101118 0.042793964 0.37967612 0.099963761 0.87372278 0.82838452 0.10599147 0.94451665 0.85590797 0.98591939 0.62301873 0.96357039 0.057097475 0.36733416 0.79627068 0.069113276 0.31738433 ] } } ]