{ "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" [ [ 0.8245985 -7.2350788 -15.0051435 ] [ 2.9001494 -9.2971358 15.5001428 ] [ -13.8747037 -6.48869 1.8231421 ] [ -6.5450988 16.0939677 1.2562553 ] [ 16.6950545 6.9269369 -3.5743968 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.321152438246749e-09 -1.159187410300572e-08 -2.404089010744909e-08 ] [ 4.646551565507148e-09 -1.48956536191627e-08 2.483396641322145e-08 ] [ -2.222972588866726e-08 -1.039602741761875e-08 2.920995649016216e-09 ] [ -1.048640427818614e-08 2.578537878485035e-08 2.01274287141609e-09 ] [ 2.674842600288184e-08 1.109817635493683e-08 -5.726814986422334e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 51.821461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.3027133269899e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1717382 1.4431274 0.2501495 ] [ 2.9382759 1.3529155 6.3386381 ] [ -1.8979003 1.3176036 3.8265235 ] [ 0.70545 6.0927437 3.6885427 ] [ 5.8468704 4.3969268 2.9309421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1717382e-10 1.4431274e-10 2.501495e-11 ] [ 2.9382759e-10 1.3529155e-10 6.3386381e-10 ] [ -1.8979003e-10 1.3176036e-10 3.8265235e-10 ] [ 7.0545e-11 6.0927437e-10 3.6885427e-10 ] [ 5.8468704e-10 4.3969268e-10 2.930942100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0043637 -0.0189112 -0.0434659 ] [ -0.0003687 -0.0223125 0.0361101 ] [ -0.0636468 -0.025888 0.0152489 ] [ -0.0012567 0.0297204 0.0014629 ] [ 0.0609085 0.0373913 -0.009356 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.99141812018496e-12 -3.029908251127296e-11 -6.964004878203072e-11 ] [ -5.907225200889601e-13 -3.57485658516e-11 5.785475799475008e-11 ] [ -1.019734149487334e-10 -4.14771483592704e-11 2.443143107291712e-11 ] [ -2.01345535935936e-12 4.761733004082432e-11 2.34382417856832e-12 ] [ 9.75861747079968e-11 5.990746668131905e-11 -1.49899644642048e-11 ] ] } "relaxed-potential-energy" { "source-value" 0.0062690184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.004407471584502e-21 } }