{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.912622 1.78272 1.2568 ] [ 2.727936 0.232034 3.207427 ] [ 3.003232 2.746828 4.7469 ] [ 4.479923 1.355966 2.983258 ] [ 4.230826 3.711883 2.275883 ] [ 5.441026 3.401037 4.285306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.912622e-10 1.78272e-10 1.2568e-10 ] [ 2.727936e-10 2.32034e-11 3.207427e-10 ] [ 3.003232e-10 2.746828e-10 4.7469e-10 ] [ 4.479923e-10 1.355966e-10 2.983258e-10 ] [ 4.230826000000001e-10 3.711883e-10 2.275883e-10 ] [ 5.441026e-10 3.401037e-10 4.285306000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.3859064 -1.0416047 4.6228308 ] [ -1.8547174 -1.3380315 0.426973 ] [ 0.0 0.0 0.0 ] [ -2.7371693 4.2284888 -5.6101915 ] [ 7.6975907 -3.7766526 12.9999545 ] [ -7.4916104 1.9278 -12.4395668 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.026996695097092e-09 -1.668834698455398e-09 7.406591429674161e-09 ] [ -2.971584856470962e-09 -2.143762787193955e-09 6.840861583128385e-10 ] [ 0.0 0.0 0.0 ] [ -4.385428659631501e-09 6.774785896674648e-09 -8.988517659510883e-09 ] [ 1.233289985602751e-08 -6.050864500603534e-09 2.082822317136375e-08 ] [ -1.200288303502214e-08 3.08867608957824e-09 -1.993038309983987e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.4407949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.114937766547874e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.0485475 1.8722703 0.2098886 ] [ 3.1848844 -0.469547 3.2661927 ] [ 2.6682504 3.2023766 5.3425294 ] [ 3.574106 1.4854732 2.308131 ] [ 4.2032611 3.0251647 3.7788651 ] [ 6.1165156 4.1147302 3.8499671 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.048547500000001e-10 1.8722703e-10 2.098886e-11 ] [ 3.1848844e-10 -4.69547e-11 3.2661927e-10 ] [ 2.6682504e-10 3.2023766e-10 5.342529400000001e-10 ] [ 3.574106e-10 1.4854732e-10 2.308131e-10 ] [ 4.2032611e-10 3.0251647e-10 3.7788651e-10 ] [ 6.1165156e-10 4.1147302e-10 3.8499671e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0742702 0.1373879 -0.5891811 ] [ 0.1593807 0.5878314 -0.4125863 ] [ -0.4978766 0.1869377 0.6212301 ] [ 0.0862479 -0.5892007 1.1595818 ] [ 0.2074888 -0.3808846 -0.7106322 ] [ 0.1190295 0.0579285 -0.0684123 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.189939780621401e-10 2.201196813608083e-10 -9.43972183837227e-10 ] [ 2.553560313467385e-10 9.418097260521332e-10 -6.610361239223751e-10 ] [ -7.976862485633933e-10 2.995072124861242e-10 9.95320342357246e-10 ] [ 1.381843689730963e-10 -9.440035864989946e-10 1.857854849865182e-09 ] [ 3.32433704437847e-10 -6.102444013427597e-10 -1.13855829682767e-09 ] [ 1.907062820855136e-10 9.281168837801281e-11 -1.096085876351558e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.054945 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.931415104402986e-18 } }