{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.5290828e-10 2.2528049e-10 1.2644891e-10 ] [ 4.470897800000001e-10 6.0847243e-10 2.0274283e-10 ] [ 3.5633524e-10 4.0839948e-10 1.9131123e-10 ] ] "source-value" [ [ 2.5290828 2.2528049 1.2644891 ] [ 4.4708978 6.0847243 2.0274283 ] [ 3.5633524 4.0839948 1.9131123 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.007154418856576e-11 7.789894882693057e-11 4.381840905524544e-11 ] [ 5.395297727011584e-11 1.06686858349465e-10 2.09468571403392e-11 ] [ -1.040246816763437e-10 -1.845858071763955e-10 -6.476526619558464e-11 ] ] "source-value" [ [ 0.0312522 0.0486207 0.0273493 ] [ 0.0336748 0.0665887 0.013074 ] [ -0.0649271 -0.1152094 -0.0404233 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.053704298157738e-19 "source-value" -5.6508778 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.730377506813567e-09 -2.008956287190491e-09 -2.303013695900965e-09 ] [ 1.01203793387166e-09 4.266379566693606e-09 -2.222621920469731e-09 ] [ 7.183395729419077e-10 -2.257423279503114e-09 4.525635616370696e-09 ] ] "source-value" [ [ -1.0800167 -1.2538919 -1.4374281 ] [ 0.6316644 2.6628647 -1.3872515 ] [ 0.4483523 -1.4089728 2.8246796 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -6.639215639076048e-19 "source-value" -4.1438725 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.808981e-10 3.144957e-10 9.820917e-11 ] [ 3.980771e-10 5.447862e-10 1.453423e-10 ] [ 3.773581e-10 3.828705e-10 2.769515e-10 ] ] "source-value" [ [ 2.808981 3.144957 0.9820917 ] [ 3.980771 5.447862 1.453423 ] [ 3.773581 3.828705 2.769515 ] ] } "instance-id" 1 }