{ "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" [ [ 0.0909404 0.3504436 2.335509 ] [ 2.174921 0.6476227 0.0631824 ] [ 2.07151 0.3484765 2.894541 ] [ 2.345183 1.577217 1.820601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.09404e-12 3.504436000000001e-11 2.335509e-10 ] [ 2.174921e-10 6.476227e-11 6.31824e-12 ] [ 2.07151e-10 3.484765e-11 2.894541e-10 ] [ 2.345183e-10 1.577217e-10 1.820601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.174973 0.0868054 -1.3256064 ] [ -0.5725977 -2.7974045 -4.8374347 ] [ 1.5390684 -12.7243185 12.0670862 ] [ 3.2085023 15.4349176 -5.9040451 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.689044133071238e-09 1.390775824391923e-10 -2.123855582462853e-09 ] [ -9.174026480638521e-10 -4.481936088820714e-09 -7.750424780986661e-09 ] [ 2.465859408292062e-09 -2.038660561631292e-08 1.933360339081831e-08 ] [ 5.140587372843028e-09 2.472946412269444e-08 -9.459323027368798e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.517342379672881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.033227107260927e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2221957 0.6763229 1.9452783 ] [ 2.0269719 0.230822 0.4549357 ] [ 2.3091195 -0.0942878 2.7983296 ] [ 2.1242672 2.1109027 1.9152898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221957e-11 6.763229e-11 1.9452783e-10 ] [ 2.0269719e-10 2.30822e-11 4.549357e-11 ] [ 2.3091195e-10 -9.42878e-12 2.7983296e-10 ] [ 2.1242672e-10 2.1109027e-10 1.9152898e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.76e-05 -1.7e-06 -1.04e-05 ] [ -5.9e-06 2.9e-06 -2e-07 ] [ 1.64e-05 -1.53e-05 1.5e-05 ] [ 7.1e-06 1.42e-05 -4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.819830852608e-14 -2.72370025536e-15 -1.666263685632e-14 ] [ -9.45284206272e-15 4.646312200320001e-15 -3.2043532416e-16 ] [ 2.627569658112e-14 -2.451330229824e-14 2.4032649312e-14 ] [ 1.137545400768e-14 2.275090801536e-14 -7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -4.0298336203271194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.456505212201934e-19 } }