{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9202746 -0.4206525 -2.9399099 ] [ 1.7973932 2.2478983 -1.1089213 ] [ -2.4814869 -1.2140832 -0.8662661 ] [ -0.410948 -0.6795402 0.338556 ] [ 2.842105 -0.4411732 2.4020088 ] [ -1.2440946 0.5704433 1.5656809 ] [ 0.4173058 -0.0628925 0.6088517 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.474442448836072e-09 -6.73959600981072e-10 -4.710254909038467e-09 ] [ 2.879741363424898e-09 3.601530102196065e-09 -1.776687781167143e-09 ] [ -3.975780296001468e-09 -1.94517571874605e-09 -1.387911292811595e-09 ] [ -6.584112779645183e-10 -1.088743421333756e-09 5.424265080315648e-10 ] [ 4.553554184858785e-09 -7.068373867635225e-10 3.848442342315863e-09 ] [ -1.993259282183528e-09 9.139509187520007e-10 2.508497333613103e-09 ] [ 6.685975964842407e-10 -1.00764893123664e-10 9.754879592743355e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.272235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.087752434756349e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5308132 1.7437865 2.4834792 ] [ 2.4524668 4.6342924 3.8710591 ] [ 0.8571908 3.2629587 2.930998 ] [ 3.9818739 2.8761249 1.0820313 ] [ 3.7391075 2.6764596 4.3154767 ] [ 3.9220161 5.0839437 2.1418817 ] [ 5.4756468 3.3744243 2.9595571 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5308132e-10 1.7437865e-10 2.4834792e-10 ] [ 2.4524668e-10 4.6342924e-10 3.8710591e-10 ] [ 8.571908e-11 3.2629587e-10 2.930998e-10 ] [ 3.9818739e-10 2.8761249e-10 1.0820313e-10 ] [ 3.7391075e-10 2.6764596e-10 4.3154767e-10 ] [ 3.9220161e-10 5.0839437e-10 2.1418817e-10 ] [ 5.4756468e-10 3.3744243e-10 2.9595571e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.4e-06 -1.69e-05 -7.1e-06 ] [ -3.17e-05 3e-07 -3e-07 ] [ 3.19e-05 2.24e-05 -1.39e-05 ] [ -3.58e-05 -7.7e-06 5e-06 ] [ 1.89e-05 -5.3e-06 3e-06 ] [ 9e-07 -3.4e-06 5.6e-06 ] [ 2.12e-05 1.06e-05 7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.65175375232e-15 -2.707678489152e-14 -1.137545400768e-14 ] [ -5.078899887936e-14 4.8065298624e-16 -4.8065298624e-16 ] [ 5.110943420352001e-14 3.588875630592e-14 -2.227025502912e-14 ] [ -5.735792302464001e-14 -1.233675998016e-14 8.010883104e-15 ] [ 3.028113813312e-14 -8.491536090240001e-15 4.8065298624e-15 ] [ 1.44195895872e-15 -5.44740051072e-15 8.972189076479999e-15 ] [ 3.396614436096001e-14 1.698307218048e-14 1.249697764224e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.541842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.611601224216751e-18 } }