[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A_hP58_164_2d3i3j" } "stoichiometric-species" { "source-value" [ "Si" ] } "a" { "source-value" 10.0833 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.00833e-09 } "parameter-names" { "source-value" [ "c/a" "z1" "z2" "x3" "z3" "x4" "z4" "x5" "z5" "x6" "y6" "z6" "x7" "y7" "z7" "x8" "y8" "z8" ] } "parameter-values" { "source-value" [ 1.6084218 0.57209015 0.42808606 0.86713483 0.49996489 0.79086101 0.6199061 0.79090544 0.37996615 0.62016406 0.62026441 0.29950117 0.00075178934 0.7546596 0.17768575 0.66716103 0.58076061 0.059221822 ] } "binding-potential-energy-per-atom" { "source-value" -2.6840793744636784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.300369257567041e-19 } "binding-potential-energy-per-formula" { "source-value" -2.6840793744636784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.300369257567041e-19 } "coordinates-file" { "source-value" "instance-1.poscar" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A_hP58_164_2d3i3j" } "stoichiometric-species" { "source-value" [ "Si" ] } "a" { "source-value" 10.0833 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.00833e-09 } "parameter-names" { "source-value" [ "c/a" "z1" "z2" "x3" "z3" "x4" "z4" "x5" "z5" "x6" "y6" "z6" "x7" "y7" "z7" "x8" "y8" "z8" ] } "parameter-values" { "source-value" [ 1.6084218 0.57209015 0.42808606 0.86713483 0.49996489 0.79086101 0.6199061 0.79090544 0.37996615 0.62016406 0.62026441 0.29950117 0.00075178934 0.7546596 0.17768575 0.66716103 0.58076061 0.059221822 ] } "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 } "coordinates-file" { "source-value" "instance-2.poscar" } } ]