{ "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" [ [ 0.7446066 0.1944515 0.1494579 ] [ 0.9752316 0.2958523 2.14555 ] [ 1.483774 1.800686 1.444998 ] [ 2.76885 0.9073334 0.4143235 ] [ 2.782831 0.444621 2.68949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.446066e-11 1.944515e-11 1.494579e-11 ] [ 9.752316e-11 2.958523e-11 2.14555e-10 ] [ 1.483774e-10 1.800686e-10 1.444998e-10 ] [ 2.76885e-10 9.073334e-11 4.143235000000001e-11 ] [ 2.782831e-10 4.44621e-11 2.68949e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.9632116 -6.209654 -10.6897632 ] [ -16.8010131 -14.467092 14.9286726 ] [ -3.407663 24.5443145 -0.1069471 ] [ 15.7977099 -0.5235776 -13.0109596 ] [ 11.3741778 -3.3439908 8.8789973 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.115629483120336e-08 -9.948962462057202e-09 -1.712688868092819e-08 ] [ -2.691819039457453e-08 -2.317883657336271e-08 2.391837021929755e-08 ] [ -5.45967799016519e-09 3.932432686546244e-08 -1.713481432823597e-10 ] [ 2.53107214639607e-08 -8.38863789894574e-10 -2.084585528529332e-08 ] [ 1.822344175198238e-08 -5.357663879930288e-09 1.422572189020632e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.8726849 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.409078448105186e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9709361 -0.2648525 0.1393639 ] [ 0.6151224 0.3751692 2.3751639 ] [ 1.3439752 2.4378002 1.5095079 ] [ 2.8869978 1.0819995 0.3623632 ] [ 2.9382617 0.0128278 2.4574204 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.709361e-11 -2.648525e-11 1.393639e-11 ] [ 6.151224e-11 3.751692e-11 2.3751639e-10 ] [ 1.3439752e-10 2.4378002e-10 1.5095079e-10 ] [ 2.8869978e-10 1.0819995e-10 3.623632e-11 ] [ 2.9382617e-10 1.28278e-12 2.4574204e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.6e-06 -7.6e-06 4.6e-06 ] [ -2.26e-05 -1.48e-05 2.07e-05 ] [ 8e-06 1.7e-05 -1.13e-05 ] [ 1.03e-05 2.32e-05 -2.31e-05 ] [ -2e-07 -1.79e-05 9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.370012455680001e-15 -1.217654231808e-14 7.370012455680001e-15 ] [ -3.620919163008e-14 -2.371221398784e-14 3.316505605055999e-14 ] [ 1.28174129664e-14 2.72370025536e-14 -1.810459581504e-14 ] [ 1.650241919424e-14 3.717049760256e-14 -3.701027994048e-14 ] [ -3.2043532416e-16 -2.867896151232001e-14 1.474002491136e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }