{ "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" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6649766 -16.6346425 -6.8842468 ] [ -15.1134327 9.8276503 -13.0548944 ] [ -16.8065502 0.5558502 14.777692 ] [ 15.2347928 -11.7129845 -5.9668916 ] [ 8.650122 -8.1901292 16.2589806 ] [ 10.417616 8.0992723 -14.0531633 ] [ 8.2824286 18.0549835 8.9225234 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.708717616989907e-08 -2.665163530886607e-08 -1.102977927477721e-08 ] [ -2.421438853197422e-08 1.574563154805811e-08 -2.091624659469284e-08 ] [ -2.692706180674157e-08 8.905701951070042e-10 2.367647263178319e-08 ] [ 2.440882884689217e-08 -1.876626992569277e-08 -9.560014220367907e-09 ] [ 1.385902323546774e-08 -1.312203352557141e-08 2.604975859536076e-08 ] [ 1.669086079967201e-08 1.297646472455305e-08 -2.251564968754458e-08 ] [ 1.326991346636527e-08 2.892727245262976e-08 1.429545839002093e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 156.65578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.509902282291882e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.6767371 -2.7211681 1.2065285 ] [ -2.4176298 6.9785118 -0.6782939 ] [ -3.1348703 3.6281407 8.716416 ] [ 9.3182758 -2.1982791 0.8507479 ] [ 6.0415084 -0.1102197 10.0650194 ] [ 7.3250754 6.8431745 -2.9280439 ] [ 5.0801506 9.251026 6.537476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.767371000000001e-11 -2.7211681e-10 1.2065285e-10 ] [ -2.4176298e-10 6.9785118e-10 -6.782939e-11 ] [ -3.1348703e-10 3.6281407e-10 8.716416000000001e-10 ] [ 9.3182758e-10 -2.1982791e-10 8.507479000000001e-11 ] [ 6.041508399999999e-10 -1.102197e-11 1.00650194e-09 ] [ 7.325075400000001e-10 6.8431745e-10 -2.9280439e-10 ] [ 5.0801506e-10 9.251025999999999e-10 6.537476e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 8.8817842e-16 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.423018699623083e-34 } }