{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7979649 -4.3811694 -10.981694 ] [ -6.3025982 2.3050436 -1.6734142 ] [ -3.4843592 -6.2526853 8.4718868 ] [ -1.0505275 9.8930123 -1.4700435 ] [ 4.0154242 -3.3332421 2.1378989 ] [ 5.8988645 1.2539108 -3.1960141 ] [ 0.1252312 0.5151302 6.71138 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.27848070699901e-09 -7.019407184444364e-09 -1.759461338357964e-08 ] [ -1.009787548633616e-08 3.693086965844667e-09 -2.681105108154735e-09 ] [ -5.582558848709392e-09 -1.001790620487983e-08 1.357345896502412e-08 ] [ -1.683130600007472e-09 1.585035301634684e-08 -2.355269327259005e-09 ] [ 6.433418775834544e-09 -5.340442564086296e-09 3.425291635214037e-09 ] [ 9.451022791167081e-09 2.008986568328625e-09 -5.120579070767154e-09 ] [ 2.00642500834729e-10 8.253295631080282e-10 1.07528161293047e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3113682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.011192657530058e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5153083 1.9564422 0.2964619 ] [ 1.1095789 2.6271742 1.9896912 ] [ 2.0172914 1.5533047 3.859005 ] [ 2.7746648 4.3395814 2.4866994 ] [ 4.1018498 1.1486829 3.0467389 ] [ 4.2651223 2.8209751 1.5151813 ] [ 2.6656844 3.6085084 4.6653764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5153083e-10 1.9564422e-10 2.964619e-11 ] [ 1.1095789e-10 2.6271742e-10 1.9896912e-10 ] [ 2.0172914e-10 1.5533047e-10 3.859005e-10 ] [ 2.7746648e-10 4.3395814e-10 2.4866994e-10 ] [ 4.1018498e-10 1.1486829e-10 3.0467389e-10 ] [ 4.2651223e-10 2.8209751e-10 1.5151813e-10 ] [ 2.6656844e-10 3.6085084e-10 4.665376400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.33e-05 -9.9e-06 1.97e-05 ] [ -1.21e-05 1.78e-05 1.73e-05 ] [ -2.21e-05 -1.01e-05 -3.25e-05 ] [ 7e-07 6.2e-06 -2.71e-05 ] [ 3.22e-05 -2.01e-05 -7.8e-06 ] [ -4.57e-05 4.7e-06 1.13e-05 ] [ 1.37e-05 1.14e-05 1.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.335248147264001e-14 -1.586154854592e-14 3.156287942976e-14 ] [ -1.938633711168e-14 2.851874385024e-14 2.771765553984e-14 ] [ -3.540810331968e-14 -1.618198387008e-14 -5.207074017599999e-14 ] [ 1.12152363456e-15 9.93349504896e-15 -4.341898642368e-14 ] [ 5.159008718975999e-14 -3.220375007808e-14 -1.249697764224e-14 ] [ -7.321947157056e-14 7.53023011776e-15 1.810459581504e-14 ] [ 2.194981970496e-14 1.826481347712e-14 3.060157345728e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }