{ "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" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 16.7294869 15.1153024 -73.1087807 ] [ -24.1485084 -28.6484327 67.9445032 ] [ -6.6561446 5.1074644 -82.4985059 ] [ 94.2791042 -22.3901787 55.88329 ] [ -80.2039381 30.8158446 31.7794933 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.680359278915987e-08 2.421738412160213e-08 -1.171331792127343e-07 ] [ -3.869017558567242e-08 -4.589984909450222e-08 1.088590945389108e-07 ] [ -1.066431926278417e-08 8.1830600532483e-09 -1.321771774039109e-07 ] [ 1.510517765792071e-07 -3.587302084867414e-08 8.953490073138644e-08 ] [ -1.285008745199104e-07 4.937242576832592e-08 5.091636118613024e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 54.082387 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.664953604845785e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5739506 0.9559339 0.7603643 ] [ 0.4776398 0.4362158 3.0787082 ] [ 2.5394881 2.2904522 0.4280647 ] [ 3.5725679 2.5374219 2.5554777 ] [ 1.1895026 2.6432349 2.5184942 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.739506e-11 9.559339000000001e-11 7.603643e-11 ] [ 4.776398e-11 4.362158e-11 3.0787082e-10 ] [ 2.5394881e-10 2.2904522e-10 4.280647e-11 ] [ 3.5725679e-10 2.5374219e-10 2.5554777e-10 ] [ 1.1895026e-10 2.6432349e-10 2.5184942e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.9e-05 1.99e-05 -4.76e-05 ] [ 5.1e-06 -3.85e-05 6.39e-05 ] [ 3.74e-05 -3e-06 -3.5e-05 ] [ -2.91e-05 6.9e-06 1.59e-05 ] [ 1.56e-05 1.47e-05 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.64631220032e-14 3.188331475392e-14 -7.626360715008e-14 ] [ 8.17110076608e-15 -6.16837999008e-14 1.0237908606912e-13 ] [ 5.992140561792e-14 -4.8065298624e-15 -5.6076181728e-14 ] [ -4.662333966527999e-14 1.105501868352e-14 2.547460827072e-14 ] [ 2.499395528448e-14 2.355199632576e-14 4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.407227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.148074564915853e-18 } }