[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B_cP144_224_ij2k_l" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 13.1403 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.31403e-09 } "parameter-names" { "source-value" [ "y1" "y2" "x3" "z3" "x4" "z4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 0.85621958 0.83564875 0.48020694 0.25153519 0.32084464 0.90709946 0.73302631 0.093665115 0.56150703 ] } "binding-potential-energy-per-atom" { "source-value" -6.902016216087994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.105824910890528e-18 } "binding-potential-energy-per-formula" { "source-value" -20.706048648263984 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.317474732671584e-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_cP144_224_ij2k_l" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 13.1403 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.31403e-09 } "parameter-names" { "source-value" [ "y1" "y2" "x3" "z3" "x4" "z4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 0.85621958 0.83564875 0.48020694 0.25153519 0.32084464 0.90709946 0.73302631 0.093665115 0.56150703 ] } "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" } } ]