[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B_hR36_167_d3e_f" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 19.017079 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.9017079e-09 } "parameter-names" { "source-value" [ "c/a" "x2" "x3" "x4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 0.40791821 0.52003642 0.80917442 0.99493488 0.45553824 0.056042641 0.61884264 ] } "binding-potential-energy-per-atom" { "source-value" -5.995599410900371 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.606009282968738e-19 } "binding-potential-energy-per-formula" { "source-value" -17.986798232701112 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.881802784890622e-18 } "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" "A2B_hR36_167_d3e_f" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 19.017079 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.9017079e-09 } "parameter-names" { "source-value" [ "c/a" "x2" "x3" "x4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 0.40791821 0.52003642 0.80917442 0.99493488 0.45553824 0.056042641 0.61884264 ] } "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" } } ]