{ "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" [ [ 2.512586 2.352376 3.000619 ] [ 5.747731 2.138199 1.702882 ] [ 4.441387 1.564453 3.266826 ] [ 5.259627 4.180433 2.034508 ] [ 3.39507 3.451757 1.390248 ] [ 4.402652 3.245897 4.59308 ] [ 3.137856 4.41534 3.36482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.512586e-10 2.352376e-10 3.000619e-10 ] [ 5.747731e-10 2.138199e-10 1.702882e-10 ] [ 4.441387e-10 1.564453e-10 3.266826e-10 ] [ 5.259627e-10 4.180433e-10 2.034508e-10 ] [ 3.39507e-10 3.451757e-10 1.390248e-10 ] [ 4.402652e-10 3.245897e-10 4.59308e-10 ] [ 3.137856000000001e-10 4.41534e-10 3.36482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.3609684 -37.2331066 4.4709773 ] [ 32.6017222 -24.6514448 -11.629679 ] [ 2.198765 -42.574157 14.7314942 ] [ 25.6077916 34.2925979 -0.6168086 ] [ -29.0900775 12.9984838 -53.119953 ] [ 20.5521994 5.3326413 27.8991039 ] [ -18.5094323 51.8349853 18.2648652 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.345016405809236e-08 -5.965401340575118e-08 7.163295361204409e-09 ] [ 5.223371753699906e-08 -3.94959688529008e-08 -1.863279995472048e-08 ] [ 3.522809906657009e-09 -6.821131955764752e-08 2.360245579114652e-08 ] [ 4.102820534986147e-08 5.494279907453745e-08 -9.882363265702524e-10 ] [ -4.660744245174912e-08 2.082586702178753e-08 -8.51075474957782e-08 ] [ 3.292825365598882e-08 8.543833288363382e-09 4.469929237811826e-08 ] [ -2.965537993966488e-08 8.304880227139347e-08 2.926354024659973e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 46.240823 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.408596614752977e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1966689 2.4300485 2.8949608 ] [ 6.1951553 2.2120001 1.9431513 ] [ 4.3263152 0.9143685 3.5148364 ] [ 5.08788 4.7158729 1.5543497 ] [ 2.9122553 3.3935029 0.3616196 ] [ 4.7388959 2.9513119 5.4083181 ] [ 3.4397384 4.7313502 3.675747 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1966689e-10 2.4300485e-10 2.8949608e-10 ] [ 6.1951553e-10 2.2120001e-10 1.9431513e-10 ] [ 4.3263152e-10 9.143685e-11 3.5148364e-10 ] [ 5.08788e-10 4.7158729e-10 1.5543497e-10 ] [ 2.9122553e-10 3.3935029e-10 3.616196e-11 ] [ 4.7388959e-10 2.9513119e-10 5.4083181e-10 ] [ 3.4397384e-10 4.7313502e-10 3.675747e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-06 2.25e-05 2.8e-06 ] [ -1e-05 3.6e-06 5.7e-06 ] [ 2.6e-05 6.5e-06 2.9e-06 ] [ 1.4e-06 -2.62e-05 1.19e-05 ] [ -2.1e-06 -4.7e-06 -1.93e-05 ] [ -1.8e-06 -7.7e-06 -2.21e-05 ] [ -1.13e-05 6.1e-06 1.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.364570931399999e-15 3.6048974265e-14 4.486094575199999e-15 ] [ -1.602176634e-14 5.767835882399999e-15 9.1324068138e-15 ] [ 4.165659248399999e-14 1.0414148121e-14 4.6463122386e-15 ] [ 2.2430472876e-15 -4.197702781079999e-14 1.90659019446e-14 ] [ -3.364570931399999e-15 -7.530230179799999e-15 -3.09220090362e-14 ] [ -2.8839179412e-15 -1.23367600818e-14 -3.54081036114e-14 ] [ -1.81045959642e-14 9.773277467399999e-15 2.899939707539999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.996931 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.043643896591025e-18 } }