{ "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" [ [ 2.141713 2.790286 2.578895 ] [ 2.447264 4.204759 1.029358 ] [ 3.674509 2.140287 1.595277 ] [ 3.884686 4.035277 2.681176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.141713e-10 2.790286e-10 2.578895e-10 ] [ 2.447264e-10 4.204759e-10 1.029358e-10 ] [ 3.674509e-10 2.140287e-10 1.595277e-10 ] [ 3.884686e-10 4.035277e-10 2.681176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -51.1201468 -9.3011176 35.3857972 ] [ -10.4528469 18.496633 -28.2699576 ] [ 33.4864638 -41.8309786 -34.1261548 ] [ 28.0865299 32.6354632 27.0103153 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.190350405482395e-08 -1.490203316603141e-08 5.66942969822101e-08 ] [ -1.674730692398176e-08 2.963487295611777e-08 -4.529346513772729e-08 ] [ 5.365122941362553e-08 -6.702061593810512e-08 -5.46761273783617e-08 ] [ 4.499958156518015e-08 5.228777614801875e-08 4.327529569409654e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.733425 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.040119583771024e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7876106 2.7262612 2.9085568 ] [ 2.428004 4.2430682 0.7520187 ] [ 3.8618303 2.0090954 1.3133236 ] [ 4.0707271 4.1921842 2.9108069 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7876106e-10 2.7262612e-10 2.9085568e-10 ] [ 2.428004e-10 4.2430682e-10 7.520187e-11 ] [ 3.8618303e-10 2.0090954e-10 1.3133236e-10 ] [ 4.0707271e-10 4.1921842e-10 2.9108069e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.11e-05 1.65e-05 2.7e-06 ] [ 2.79e-05 -2.76e-05 1.36e-05 ] [ -2.09e-05 2.94e-05 -7.2e-06 ] [ -3.81e-05 -1.83e-05 -9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.982769290688e-14 2.64359142432e-14 4.32587687616e-15 ] [ 4.470072772032e-14 -4.422007473408001e-14 2.178960204288e-14 ] [ -3.348549137472e-14 4.710399265152e-14 -1.153567166976e-14 ] [ -6.104292925248e-14 -2.931983216064e-14 -1.44195895872e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.114379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.940937480931048e-18 } }