{ "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" [ [ 1.691051 2.220945 1.919277 ] [ 2.666072 2.808957 4.219459 ] [ 1.090931 4.286689 3.184511 ] [ 3.947256 1.730986 2.765408 ] [ 5.245402 2.932614 3.956238 ] [ 3.932067 4.011287 2.276365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.691051e-10 2.220945e-10 1.919277e-10 ] [ 2.666072e-10 2.808957e-10 4.219459e-10 ] [ 1.090931e-10 4.286689e-10 3.184511e-10 ] [ 3.947256e-10 1.730986e-10 2.765408e-10 ] [ 5.245402000000001e-10 2.932614e-10 3.956238e-10 ] [ 3.932067e-10 4.011287e-10 2.276365e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6093265 1.4874441 -2.4095958 ] [ -7.1877348 0.9413418 7.7434088 ] [ -0.3840728 0.1969204 -0.5040263 ] [ 0.8013611 -14.7357954 -4.3824478 ] [ 13.9972962 -0.1522313 10.0528383 ] [ -5.6175231 12.2623204 -10.5001772 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.578425293533891e-09 2.383148161766897e-09 -3.860598056337873e-09 ] [ -1.151602065307057e-08 1.50819582414179e-09 1.240630854465698e-08 ] [ -6.153524608451942e-10 3.155012610385843e-10 -8.075391541283271e-10 ] [ 1.283922019238571e-09 -2.360934687877219e-08 -7.021455407036394e-09 ] [ 2.242614072605268e-08 -2.439014298139911e-10 1.610642249694282e-08 ] [ -9.00026417762394e-09 1.96464030616389e-08 -1.682313842409721e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.679318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.512103672968862e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.742261 2.253226 1.9857069 ] [ 2.6949531 2.7182695 4.2897713 ] [ 1.2814258 4.4867605 3.1302531 ] [ 4.0444217 1.4577704 2.5511783 ] [ 5.1965823 3.1339557 4.0919377 ] [ 3.6131351 3.941496 2.2724106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.742261e-10 2.253226e-10 1.9857069e-10 ] [ 2.6949531e-10 2.7182695e-10 4.2897713e-10 ] [ 1.2814258e-10 4.4867605e-10 3.1302531e-10 ] [ 4.0444217e-10 1.4577704e-10 2.5511783e-10 ] [ 5.1965823e-10 3.1339557e-10 4.0919377e-10 ] [ 3.6131351e-10 3.941496e-10 2.2724106e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.46e-05 6e-07 -8.01e-05 ] [ -3.34e-05 -1.66e-05 3.09e-05 ] [ -3.68e-05 4.12e-05 4.8e-05 ] [ 3.8e-05 -0.0001086 -2.6e-05 ] [ 8.42e-05 9.29e-05 5.91e-05 ] [ 4.26e-05 -9.5e-06 -3.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.5156590832768e-13 9.6130597248e-16 -1.2833434732608e-13 ] [ -5.351269913472e-14 -2.659613190528e-14 4.950725758272e-14 ] [ -5.896009964544001e-14 6.600967677696001e-14 7.69044777984e-14 ] [ 6.08827115904e-14 -1.7399638101888e-13 -4.16565921408e-14 ] [ 1.3490327147136e-13 1.4884220807232e-13 9.468863828927999e-14 ] [ 6.825272404608e-14 -1.52206778976e-14 -5.110943420352001e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.308234 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.574173096613567e-18 } }