[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A3B4_hP28_159_2c_ab2c" } "stoichiometric-species" { "source-value" [ "C" "N" ] } "a" { "source-value" 6.6561 "source-unit" "angstrom" "si-unit" "m" "si-value" 6.6561e-10 } "binding-potential-energy-per-atom" { "source-value" -5.781077243292804 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.262306878552864e-19 } "binding-potential-energy-per-formula" { "source-value" -40.46754070304963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.483614814987005e-18 } "parameter-names" { "source-value" [ "c/a" "z1" "z2" "x3" "y3" "z3" "x4" "y4" "z4" "x5" "y5" "z5" "x6" "y6" "z6" ] } "parameter-values" { "source-value" [ 0.72320127 0.00033758595 0.1443896 0.078619597 0.56423893 0.20176364 0.2536244 0.087319431 0.99128049 0.95601442 0.61037634 0.96876506 0.32596693 0.01383629 0.24614754 ] } "library-prototype-label" { "source-value" "A4B3_hP28_159_ab2c_2c-001" } "short-name" { "source-value" "Nierite" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A3B4_hP28_159_2c_ab2c" } "stoichiometric-species" { "source-value" [ "C" "N" ] } "a" { "source-value" 6.6561 "source-unit" "angstrom" "si-unit" "m" "si-value" 6.6561e-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" "z1" "z2" "x3" "y3" "z3" "x4" "y4" "z4" "x5" "y5" "z5" "x6" "y6" "z6" ] } "parameter-values" { "source-value" [ 0.72320127 0.00033758595 0.1443896 0.078619597 0.56423893 0.20176364 0.2536244 0.087319431 0.99128049 0.95601442 0.61037634 0.96876506 0.32596693 0.01383629 0.24614754 ] } "library-prototype-label" { "source-value" "A4B3_hP28_159_ab2c_2c-001" } "short-name" { "source-value" "Nierite" } } ]