{ "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" [ [ 1.02058 1.85993 1.630827 ] [ 2.141944 2.227969 3.994537 ] [ 1.553014 3.937737 2.507181 ] [ 3.345417 1.636187 2.240659 ] [ 3.907909 3.941805 1.929299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.02058e-10 1.85993e-10 1.630827e-10 ] [ 2.141944e-10 2.227969e-10 3.994537e-10 ] [ 1.553014e-10 3.937737e-10 2.507181e-10 ] [ 3.345417e-10 1.636187e-10 2.240659e-10 ] [ 3.907909e-10 3.941805e-10 1.929299e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6239792 -0.2601246 1.1766002 ] [ -0.8718646 0.3869769 -0.4643441 ] [ 1.1592452 -0.1792521 -0.2666862 ] [ 0.0485602 0.7311897 -1.1509088 ] [ -0.95992 -0.6787899 0.7053388 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.997248861054873e-10 -4.167655526149517e-10 1.885121332468604e-09 ] [ -1.396881078623144e-09 6.200053419696596e-10 -7.439612610264173e-10 ] [ 1.85731555721462e-09 -2.871935238493037e-10 -4.27278394729993e-10 ] [ 7.780201714137216e-11 1.171495042709766e-09 -1.843959172032983e-09 ] [ -1.537961381838336e-09 -1.08754130821517e-09 1.130077335103127e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.540349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.130709033007266e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9071075 1.6347547 2.1751522 ] [ 2.3211845 2.4489198 3.8731857 ] [ 1.6808768 3.8425208 1.9053537 ] [ 3.1792602 1.8707311 1.6029755 ] [ 3.880435 3.8067016 2.745836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.071075e-11 1.6347547e-10 2.1751522e-10 ] [ 2.3211845e-10 2.4489198e-10 3.8731857e-10 ] [ 1.6808768e-10 3.8425208e-10 1.9053537e-10 ] [ 3.1792602e-10 1.8707311e-10 1.6029755e-10 ] [ 3.880435e-10 3.8067016e-10 2.745836e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.24e-05 -3.6e-06 4.33e-05 ] [ -4.63e-05 -2.06e-05 -1.4e-05 ] [ 1.92e-05 -9.5e-06 -1.13e-05 ] [ -4.7e-06 2.57e-05 -1.69e-05 ] [ 1.94e-05 8e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.986699009792e-14 -5.76783583488e-15 6.937424768064e-14 ] [ -7.418077754303999e-14 -3.300483838848e-14 -2.24304726912e-14 ] [ 3.076179111936e-14 -1.52206778976e-14 -1.810459581504e-14 ] [ -7.53023011776e-15 4.117593915456e-14 -2.707678489152e-14 ] [ 3.108222644352e-14 1.28174129664e-14 -1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }