{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.060429 2.678734 2.453953 ] [ 2.544795 1.257014 4.108114 ] [ 3.849483 1.551428 2.063601 ] [ 4.178567 2.654376 4.014408 ] [ 4.257126 3.923601 2.295059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.060429e-10 2.678734e-10 2.453953e-10 ] [ 2.544795e-10 1.257014e-10 4.108114e-10 ] [ 3.849483e-10 1.551428e-10 2.063601e-10 ] [ 4.178567e-10 2.654376e-10 4.014408000000001e-10 ] [ 4.257126000000001e-10 3.923601e-10 2.295059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -39.0901783 65.3716234 -23.4258146 ] [ -36.730402 -25.8251936 29.7648885 ] [ 54.9404856 -100.2888013 -49.8163728 ] [ 58.5050209 -6.6301202 72.9473466 ] [ -37.6249262 67.3724916 -29.4700478 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.262937029115383e-08 1.047368875381276e-07 -3.753229278453605e-08 ] [ -5.884859184182686e-08 -4.137652175444634e-08 4.76886088683153e-08 ] [ 8.802436228893347e-08 -1.606803740947288e-07 -7.981462849079315e-08 ] [ 9.373537745766163e-08 -1.062262366505141e-08 1.168745342348193e-07 ] [ -6.02817776136144e-08 1.079426318158813e-07 -4.72162219880231e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 54.2643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.694099352036619e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4886439 2.9904846 2.1805194 ] [ 2.3237556 1.1040326 4.2509506 ] [ 4.1585117 1.1101827 1.7606039 ] [ 4.7605029 2.6819847 4.5902911 ] [ 4.1589859 4.1784684 2.1527699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4886439e-10 2.9904846e-10 2.1805194e-10 ] [ 2.3237556e-10 1.1040326e-10 4.2509506e-10 ] [ 4.1585117e-10 1.1101827e-10 1.7606039e-10 ] [ 4.7605029e-10 2.6819847e-10 4.5902911e-10 ] [ 4.158985900000001e-10 4.1784684e-10 2.1527699e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.62e-05 2.36e-05 -1.96e-05 ] [ 1.83e-05 2.65e-05 9.7e-06 ] [ 4.02e-05 -3.44e-05 3.1e-06 ] [ 5.9e-06 -3.67e-05 2.2e-06 ] [ -1.82e-05 2.1e-05 4.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.40205604908e-14 3.78113685624e-14 -3.140266202639999e-14 ] [ 2.93198324022e-14 4.2457680801e-14 1.55411133498e-14 ] [ 6.44075006868e-14 -5.51148762096e-14 4.9667475654e-15 ] [ 9.452842140600001e-15 -5.879988246779999e-14 3.5247885948e-15 ] [ -2.915961473879999e-14 3.364570931399999e-14 7.209794853e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.044174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929689415863031e-18 } }