{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.6598269 -1.8476872 -14.2796496 ] [ 11.2205654 3.2493786 9.313437 ] [ -7.8430698 -3.1244722 0.2915191 ] [ -6.2057301 8.8130879 1.9590947 ] [ 0.1684077 -7.0903071 2.7155988 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.261512509664655e-09 -2.960321258780884e-09 -2.287852093082744e-08 ] [ 1.797732770414886e-08 5.206078467939632e-09 1.492177114363106e-08 ] [ -1.256598317239105e-08 -5.005956352422575e-09 4.670650903847093e-10 ] [ -9.942675763130483e-09 1.412012350676813e-08 3.13881575213324e-09 ] [ 2.698188819256818e-10 -1.13599243635043e-08 4.350868944678439e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7617125 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.424751237325724e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.97291 2.0500452 1.7732616 ] [ 2.8335008 3.1385107 4.8149503 ] [ 0.4276156 2.3340791 3.0397365 ] [ 0.7745175 4.4344447 4.3180025 ] [ 3.7558904 2.6462372 3.0888451 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.97291e-10 2.0500452e-10 1.7732616e-10 ] [ 2.8335008e-10 3.1385107e-10 4.814950299999999e-10 ] [ 4.276156e-11 2.3340791e-10 3.0397365e-10 ] [ 7.745175e-11 4.4344447e-10 4.318002500000001e-10 ] [ 3.7558904e-10 2.6462372e-10 3.0888451e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 1.06e-05 -4.9e-06 ] [ 3.54e-05 2e-06 -7.02e-05 ] [ 1.36e-05 1.84e-05 1.11e-05 ] [ -1.97e-05 -2.04e-05 -7e-07 ] [ -2.76e-05 -1.05e-05 6.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8839179412e-15 1.69830723204e-14 -7.850665506599998e-15 ] [ 5.671705284359999e-14 3.204353268e-15 -1.124727997068e-13 ] [ 2.17896022224e-14 2.94800500656e-14 1.77841606374e-14 ] [ -3.15628796898e-14 -3.26844033336e-14 -1.1215236438e-15 ] [ -4.42200750984e-14 -1.6822854657e-14 1.036608282198e-13 ] ] } "relaxed-potential-energy" { "source-value" -11.295169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.809685584888114e-18 } }