{ "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" [ [ 1.724599 2.153048 2.374712 ] [ 0.8645185 3.613019 0.4039649 ] [ 2.279761 4.306527 2.243044 ] [ 4.11856 1.980977 2.568835 ] [ 3.209467 2.952847 0.6643367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724599e-10 2.153048e-10 2.374712e-10 ] [ 8.645185e-11 3.613019e-10 4.039649e-11 ] [ 2.279761e-10 4.306527e-10 2.243044e-10 ] [ 4.118560000000001e-10 1.980977e-10 2.568835e-10 ] [ 3.209467e-10 2.952847e-10 6.643367000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.7027325 -30.7626219 17.191227 ] [ -11.1114572 3.1143392 -9.0388284 ] [ 1.0561084 35.5263115 14.292196 ] [ 11.9887838 -6.9803613 10.562427 ] [ 18.7692974 -0.8976676 -33.0070216 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.316943399817633e-08 -4.928715360269008e-08 2.754338198226572e-08 ] [ -1.780251694885983e-08 4.989721455480975e-09 -1.448179954190307e-08 ] [ 1.692072187510495e-09 5.691942570855818e-08 2.289862229109128e-08 ] [ 1.920814911618579e-08 -1.118377167959709e-08 1.692287359830668e-08 ] [ 3.007172948312222e-08 -1.438222041969646e-09 -5.288307832976062e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6824677 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.502140276591149e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7493476 2.3015202 2.708795 ] [ 0.8732097 3.2316073 0.3472824 ] [ 1.9518014 4.9242764 2.1707752 ] [ 4.0945016 1.2657984 2.2826549 ] [ 3.5280453 3.2832157 0.7453851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7493476e-10 2.3015202e-10 2.708795e-10 ] [ 8.732097e-11 3.2316073e-10 3.472824e-11 ] [ 1.9518014e-10 4.924276400000001e-10 2.1707752e-10 ] [ 4.0945016e-10 1.2657984e-10 2.2826549e-10 ] [ 3.5280453e-10 3.2832157e-10 7.453851e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.07e-05 -7.86e-05 -5.35e-05 ] [ -6.93e-05 1.22e-05 1.93e-05 ] [ -1.43e-05 8.05e-05 2.4e-06 ] [ -3.88e-05 4.96e-05 1.17e-05 ] [ 7.17e-05 -6.37e-05 2.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.123035467456e-14 -1.2593108239488e-13 -8.57164492128e-14 ] [ -1.1103083982144e-13 1.954655477376e-14 3.092200878144e-14 ] [ -2.291112567744e-14 1.289752179744e-13 3.84522388992e-15 ] [ -6.216445288704e-14 7.946796039168e-14 1.874546646336e-14 ] [ 1.1487606371136e-13 -1.0205865074496e-13 3.252418540224e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.624493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.663537401725326e-18 } }