{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9766448 -4.7406875 -2.7160363 ] [ 3.2118058 1.3880593 0.5548083 ] [ -0.5943788 -1.5609428 -0.1396561 ] [ -4.4624332 -0.330279 -2.6497342 ] [ -1.174364 4.048845 1.0029285 ] [ -0.3324388 -0.8962472 -0.5013129 ] [ 4.3284539 2.0912522 4.4490026 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.564757465385892e-09 -7.5954186790188e-09 -4.351569861104135e-09 ] [ 5.145880163309842e-09 2.223916158744013e-09 8.889008872857927e-10 ] [ -9.52299817259159e-10 -2.50090606056609e-09 -2.237537383721069e-10 ] [ -7.149606144921731e-09 -5.291652921412032e-10 -4.245342186574192e-09 ] [ -1.881538545109171e-09 6.486964800242976e-09 1.606868595034013e-09 ] [ -5.32625673206807e-10 -1.435946310297462e-09 -8.031918080854483e-10 ] [ 6.934947642790582e-09 3.350555383036566e-09 7.128087951598414e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.636477 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.466545760587692e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4881245 2.7508139 1.9638579 ] [ 2.7801682 0.7237391 3.2855994 ] [ 2.4550076 2.8681982 4.398285 ] [ 4.159495 1.1009437 1.3113489 ] [ 4.5978151 2.346046 3.3604752 ] [ 4.6868077 3.4785231 1.2038819 ] [ 3.633376 4.5707478 3.1117104 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4881245e-10 2.7508139e-10 1.9638579e-10 ] [ 2.7801682e-10 7.237391e-11 3.2855994e-10 ] [ 2.4550076e-10 2.8681982e-10 4.398285e-10 ] [ 4.159495e-10 1.1009437e-10 1.3113489e-10 ] [ 4.5978151e-10 2.346046e-10 3.3604752e-10 ] [ 4.6868077e-10 3.4785231e-10 1.2038819e-10 ] [ 3.633376e-10 4.5707478e-10 3.111710400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.84e-05 8.5e-06 -6.4e-06 ] [ 9e-06 4.42e-05 5.4e-06 ] [ 1e-05 -6.6e-06 -7.9e-06 ] [ 6e-07 6.6e-06 9.3e-06 ] [ -2.09e-05 -2.3e-06 -1.64e-05 ] [ -1.9e-05 -1.69e-05 -7e-07 ] [ -1.81e-05 -3.36e-05 1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.152358223872e-14 1.36185012768e-14 -1.025393037312e-14 ] [ 1.44195895872e-14 7.081620663936001e-14 8.65175375232e-15 ] [ 1.6021766208e-14 -1.057436569728e-14 -1.265719530432e-14 ] [ 9.6130597248e-16 1.057436569728e-14 1.490024257344e-14 ] [ -3.348549137472e-14 -3.68500622784e-15 -2.627569658112e-14 ] [ -3.04413557952e-14 -2.707678489152e-14 -1.12152363456e-15 ] [ -2.899939683648e-14 -5.383313445888e-14 2.675634956736e-14 ] ] } "relaxed-potential-energy" { "source-value" -31.275942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.010958306589679e-18 } }