{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 12.93967 -3.9841842 5.3794886 ] [ 3.8213126 -3.6663523 -0.6276136 ] [ -3.8213126 3.6663523 0.6276136 ] [ -12.9583298 4.5032714 -5.5008392 ] [ 0.0186598 -0.5190873 0.1213506 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.073163675486714e-08 -6.383366778200752e-09 8.618890866780123e-09 ] [ 6.122417708488463e-09 -5.874143938676307e-09 -1.005547836816123e-09 ] [ -6.122417708488463e-09 5.874143938676307e-09 1.005547836816123e-09 ] [ -2.076153305017594e-08 7.215036154197285e-09 -8.813315961020175e-09 ] [ 2.989629530880384e-11 -8.31669536214196e-10 1.944250942400525e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -2.0010843 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.206090481709934e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7720663 2.8330032 3.0277904 ] [ 2.4539216 3.2343117 0.8889115 ] [ 3.2666436 4.0168192 -1.0006068 ] [ 4.0917979 2.9194883 4.7878056 ] [ 6.0485536 3.4822727 5.6204203 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7720663e-10 2.8330032e-10 3.0277904e-10 ] [ 2.4539216e-10 3.2343117e-10 8.889115e-11 ] [ 3.2666436e-10 4.0168192e-10 -1.0006068e-10 ] [ 4.091797900000001e-10 2.9194883e-10 4.787805600000001e-10 ] [ 6.0485536e-10 3.4822727e-10 5.6204203e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0256854 -0.0499558 0.2457677 ] [ 0.0556673 0.0723824 -0.2066233 ] [ -0.0822053 -0.0256474 -0.0265178 ] [ -0.0642077 0.006709 -0.1310896 ] [ 0.0650602 -0.0034881 0.118463 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.115254737589632e-11 -8.003801483336064e-11 3.937632630877882e-10 ] [ 8.918884660305984e-11 1.159693890373939e-10 -3.310470205725447e-10 ] [ -1.317074097658502e-10 -4.109166466430592e-11 -4.248619919505024e-11 ] [ -1.028720758153402e-10 1.07490029489472e-11 -2.100286923500237e-10 ] [ 1.042379313845722e-10 -5.588552271012479e-12 1.897986490298304e-10 ] ] } "relaxed-potential-energy" { "source-value" -11.101548 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.7786640660289e-18 } }