{ "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" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.3969496 -6.1475807 7.4151075 ] [ -52.7606562 22.5774161 31.7978722 ] [ 7.4232874 -10.0231268 -6.248315 ] [ 9.2512854 -17.9296803 38.6449493 ] [ 51.483033 11.5229717 -71.609614 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.466863288399564e-08 -9.849510153169361e-09 1.188031197509815e-08 ] [ -8.453189055814722e-08 3.61730085315154e-08 5.094580784975817e-08 ] [ 1.189341761974661e-08 -1.605881955857919e-08 -1.001090429487171e-08 ] [ 1.482219330234534e-08 -2.872651483175011e-08 6.191603479057466e-08 ] [ 8.24849125200509e-08 1.846183601198325e-08 -1.147312503205593e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 2.6673554 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.273574496453723e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3056158 1.3796989 3.1053468 ] [ 1.4986027 3.9880586 3.1522507 ] [ 3.5267719 1.2400779 1.7305892 ] [ 3.5732205 2.5045923 4.1660073 ] [ 3.7197551 3.8484382 1.7774881 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3056158e-10 1.3796989e-10 3.1053468e-10 ] [ 1.4986027e-10 3.9880586e-10 3.1522507e-10 ] [ 3.5267719e-10 1.2400779e-10 1.7305892e-10 ] [ 3.5732205e-10 2.5045923e-10 4.1660073e-10 ] [ 3.7197551e-10 3.8484382e-10 1.7774881e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 -5e-06 2e-06 ] [ -2.6e-06 4.5e-06 3.3e-06 ] [ -1e-07 -3e-07 3.3e-06 ] [ -4e-06 -2e-07 -9e-06 ] [ 5.5e-06 1e-06 4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.0828296242e-15 -8.010883169999999e-15 3.204353268e-15 ] [ -4.165659248399999e-15 7.209794853e-15 5.2871828922e-15 ] [ -1.602176634e-16 -4.806529901999999e-16 5.2871828922e-15 ] [ -6.408706535999999e-15 -3.204353268e-16 -1.4419589706e-14 ] [ 8.811971486999999e-15 1.602176634e-15 6.408706536e-16 ] ] } "relaxed-potential-energy" { "source-value" -16.806069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.692629106119175e-18 } }