[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B_tI96_141_fg2h_i" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 8.853 "source-unit" "angstrom" "si-unit" "m" "si-value" 8.853e-10 } "binding-potential-energy-per-atom" { "source-value" -6.530295482884463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.046268683579323e-18 } "binding-potential-energy-per-formula" { "source-value" -19.59088644865339 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.13880605073797e-18 } "parameter-names" { "source-value" [ "c/a" "x1" "x2" "y3" "z3" "y4" "z4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 2.3212583 0.7297707 0.22672077 0.08522865 0.19310984 0.48628067 0.57750371 0.32231207 0.41865684 0.31567506 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A2B_tI96_141_fg2h_i" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 8.853 "source-unit" "angstrom" "si-unit" "m" "si-value" 8.853e-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" [ "c/a" "x1" "x2" "y3" "z3" "y4" "z4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 2.3212583 0.7297707 0.22672077 0.08522865 0.19310984 0.48628067 0.57750371 0.32231207 0.41865684 0.31567506 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 3 "prototype-label" { "source-value" "A2B_tI96_141_fg2h_i" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 10.2711 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.02711e-09 } "binding-potential-energy-per-atom" { "source-value" -6.473828955588523 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.037221748515655e-18 } "binding-potential-energy-per-formula" { "source-value" -19.42148686676557 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.111665245546966e-18 } "parameter-names" { "source-value" [ "c/a" "x1" "x2" "y3" "z3" "y4" "z4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 2.0170868 0.29771559 0.30985771 0.6105032 0.54984127 0.95656428 0.70930634 0.14547202 0.095145332 0.30296948 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 4 "prototype-label" { "source-value" "A2B_tI96_141_fg2h_i" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 10.2711 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.02711e-09 } "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" [ "c/a" "x1" "x2" "y3" "z3" "y4" "z4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 2.0170868 0.29771559 0.30985771 0.6105032 0.54984127 0.95656428 0.70930634 0.14547202 0.095145332 0.30296948 ] } } ]