{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.545864 6.091838 1.499613 ] [ 2.179305 3.563192 1.435059 ] [ 4.130428 2.365833 1.412571 ] [ 3.615446 4.837513 1.97252 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.545864e-10 6.091838e-10 1.499613e-10 ] [ 2.179305e-10 3.563192e-10 1.435059e-10 ] [ 4.130428e-10 2.365833e-10 1.412571e-10 ] [ 3.615446e-10 4.837513e-10 1.97252e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1584063 -0.3156041 -0.0852491 ] [ -9.4606774 -5.4283698 -2.863323 ] [ 1.6418321 -1.2620046 -0.093695 ] [ 7.9772516 7.0059784 3.0422671 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.53794870447431e-10 -5.056535104486253e-10 -1.365841149642413e-10 ] [ -1.515767614721093e-08 -8.697207182616771e-09 -4.587549168398918e-09 ] [ 2.630505005898968e-09 -2.021954265462056e-09 -1.50115938485856e-10 ] [ 1.278096601175939e-08 1.122481479830979e-08 4.874249221849016e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1567884 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.26208581289264e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8734453 5.5723014 1.6021059 ] [ 1.5538674 3.2595579 1.1393799 ] [ 3.8620746 2.8568863 1.5577776 ] [ 4.1816557 5.1696304 2.0204996 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8734453e-10 5.5723014e-10 1.6021059e-10 ] [ 1.5538674e-10 3.2595579e-10 1.1393799e-10 ] [ 3.8620746e-10 2.8568863e-10 1.5577776e-10 ] [ 4.1816557e-10 5.1696304e-10 2.0204996e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.01e-05 -4.7e-06 -6e-07 ] [ -1.06e-05 1.6e-06 -1e-07 ] [ 8.3e-06 4.3e-06 6e-07 ] [ -7.7e-06 -1.2e-06 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.618198387008e-14 -7.53023011776e-15 -9.6130597248e-16 ] [ -1.698307218048e-14 2.56348259328e-15 -1.6021766208e-16 ] [ 1.329806595264e-14 6.889359469440001e-15 9.6130597248e-16 ] [ -1.233675998016e-14 -1.92261194496e-15 1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -8.6379755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383956239714319e-18 } }