{ "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" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1705159 -12.0895623 -5.4301342 ] [ -18.877731 6.9070896 -0.8198187 ] [ -3.0742131 -4.5743684 20.7448622 ] [ 13.1134702 0.8905248 4.4480034 ] [ 15.0089898 8.8663164 -18.9429127 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.886256394705479e-09 -1.93696142323473e-08 -8.700034134724282e-09 ] [ -3.024545951113745e-08 1.10663775660644e-08 -1.313494365256256e-09 ] [ -4.925432396756706e-09 -7.328946165787965e-09 3.323693349238983e-08 ] [ 2.101009554509531e-08 1.426778026557523e-09 7.126487115432556e-09 ] [ 2.404705275750433e-08 1.4205404965731e-08 -3.034989210784185e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.3409079 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.954901207726009e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5909347 -0.101154 0.7356114 ] [ 0.8964429 2.1684061 0.9149008 ] [ 1.5506073 2.1877047 3.2033644 ] [ 2.2450934 -0.081854 3.0240716 ] [ 1.2394771 3.8351142 -0.6253814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5909347e-10 -1.01154e-11 7.356114e-11 ] [ 8.964429000000001e-11 2.1684061e-10 9.149007999999999e-11 ] [ 1.5506073e-10 2.1877047e-10 3.2033644e-10 ] [ 2.2450934e-10 -8.1854e-12 3.0240716e-10 ] [ 1.2394771e-10 3.8351142e-10 -6.253814e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 7.7e-06 -1.74e-05 ] [ 1.7e-05 -5.15e-05 3.69e-05 ] [ -2.3e-06 1.27e-05 -1.17e-05 ] [ -1.22e-05 2.89e-05 -1.51e-05 ] [ 5.2e-06 2.2e-06 7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.23367600818e-14 1.23367600818e-14 -2.78778734316e-14 ] [ 2.723700277799999e-14 -8.251209665099998e-14 5.91203177946e-14 ] [ -3.685006258199999e-15 2.03476432518e-14 -1.87454666178e-14 ] [ -1.95465549348e-14 4.63029047226e-14 -2.41928671734e-14 ] [ 8.331318496799998e-15 3.5247885948e-15 1.16958894282e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.301703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.81073244710077e-18 } }