{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.638444 0.1037795 1.566109 ] [ 2.272296 0.012464 2.947777 ] [ 1.706904 2.720714 0.1698745 ] [ 2.81231 2.888436 1.350646 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.38444e-11 1.037795e-11 1.566109e-10 ] [ 2.272296e-10 1.2464e-12 2.947777e-10 ] [ 1.706904e-10 2.720714e-10 1.698745e-11 ] [ 2.81231e-10 2.888436e-10 1.350646e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2743311 1.1370221 -1.9379598 ] [ 1.9160467 0.4718515 1.2042264 ] [ -12.7092008 -2.6200603 -12.8728294 ] [ 12.0674852 1.0111867 13.6065627 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.041703495578347e-09 1.82171022595292e-09 -3.104953883610244e-09 ] [ 3.069845227100991e-09 7.559894417894112e-10 1.929383384230149e-09 ] [ -2.036238439081265e-08 -4.197799357746234e-09 -2.062454630822689e-08 ] [ 1.933424265929001e-08 1.620099690003903e-09 2.180011664738932e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.86020077967288 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.58254681998582e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.639712 0.3320609 1.2270817 ] [ 2.3862965 0.5162266 2.7945208 ] [ 1.3286838 2.3464674 0.2226791 ] [ 3.0752617 2.5306386 1.7901249 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.39712e-11 3.320609e-11 1.2270817e-10 ] [ 2.3862965e-10 5.162266e-11 2.7945208e-10 ] [ 1.3286838e-10 2.3464674e-10 2.226791e-11 ] [ 3.0752617e-10 2.5306386e-10 1.7901249e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 -2.4e-06 -1.3e-06 ] [ -3e-07 1.3e-06 -2e-07 ] [ -3e-07 -3e-07 1.1e-06 ] [ 2.8e-06 1.5e-06 4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 -3.84522388992e-15 -2.08282960704e-15 ] [ -4.8065298624e-16 2.08282960704e-15 -3.2043532416e-16 ] [ -4.8065298624e-16 -4.8065298624e-16 1.76239428288e-15 ] [ 4.48609453824e-15 2.4032649312e-15 6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -3.86421462032712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.19115432244166e-19 } }