{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.104984 0.7498219 0.2438631 ] [ 0.0561128 2.748087 0.5245136 ] [ 1.296365 1.928403 2.567713 ] [ 2.230186 0.0250453 1.984887 ] [ 2.914783 2.131976 0.9359872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.104984e-10 7.498219000000001e-11 2.438631e-11 ] [ 5.61128e-12 2.748087e-10 5.245136000000001e-11 ] [ 1.296365e-10 1.928403e-10 2.567713e-10 ] [ 2.230186e-10 2.50453e-12 1.984887e-10 ] [ 2.914783e-10 2.131976e-10 9.359872e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.8759155 -6.2071961 -12.5916926 ] [ -0.8335224 1.2676228 0.7900475 ] [ -7.8306253 7.9041112 11.0806172 ] [ 1.9508472 -21.063836 9.9939959 ] [ 15.589216 18.0992981 -9.272968 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.422078430229634e-08 -9.94502447214094e-09 -2.017411550002037e-08 ] [ -1.335450102193106e-09 2.030955614153034e-09 1.265795633821488e-09 ] [ -1.254604478190499e-08 1.266378217284343e-08 1.775310582187436e-08 ] [ 3.125601774593141e-09 -3.374798558356538e-08 1.601214657935106e-08 ] [ 2.49766774118013e-08 2.899827226870986e-08 -1.485693253502654e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.060954 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.772160190254424e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2332895 1.0267334 0.0302582 ] [ -0.4902216 2.5388521 0.7740949 ] [ 1.3086768 2.2601416 2.3541475 ] [ 2.1405244 -0.1143997 2.0969714 ] [ 3.4101617 1.8720058 1.0014918 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2332895e-10 1.0267334e-10 3.02582e-12 ] [ -4.902216e-11 2.5388521e-10 7.740949000000001e-11 ] [ 1.3086768e-10 2.2601416e-10 2.3541475e-10 ] [ 2.1405244e-10 -1.143997e-11 2.0969714e-10 ] [ 3.4101617e-10 1.8720058e-10 1.0014918e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.4e-06 -1.04e-05 -2.92e-05 ] [ -3.83e-05 -2.79e-05 1.02e-05 ] [ 2.6e-05 2.09e-05 1.66e-05 ] [ -3.52e-05 2.33e-05 -1.63e-05 ] [ 5.19e-05 -5.8e-06 1.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.04957713152e-15 -1.666263685632e-14 -4.678355732736e-14 ] [ -6.136336457664001e-14 -4.470072772032e-14 1.634220153216e-14 ] [ 4.16565921408e-14 3.348549137472e-14 2.659613190528e-14 ] [ -5.639661705216e-14 3.733071526464e-14 -2.611547891904e-14 ] [ 8.315296661952001e-14 -9.292624400640001e-15 2.996070280896e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.808942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693089389278319e-18 } }