{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9426217 1.2849851 3.41297 ] [ -3.9634968 1.3092683 7.9566172 ] [ -1.9172838 -0.7016681 -5.2708493 ] [ -3.8367861 -10.7346325 -1.5727714 ] [ 1.3292857 1.7427021 -12.1954686 ] [ -4.4430653 7.9461664 -0.442293 ] [ 13.773968 -0.8468213 8.111795 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.510246449998751e-09 2.05877308529635e-09 5.468180741491776e-09 ] [ -6.350221909575614e-09 2.097679060614561e-09 1.274790605849516e-08 ] [ -3.071827279798583e-09 -1.124196225381156e-09 -8.444831520220046e-09 ] [ -6.147208988430411e-09 -1.719877722437986e-08 -2.519857566942885e-09 ] [ 2.129750470903763e-09 2.792116561639064e-09 -1.953929467062051e-08 ] [ -7.118575348347738e-09 1.27311620310665e-08 -7.086315041434943e-10 ] [ 2.206832950524733e-08 -1.356757288855463e-09 1.299652830172234e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8476671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.097117213464134e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6956871 3.016242 2.240288 ] [ 1.7687875 2.3153491 5.8061023 ] [ 1.2218316 3.2417543 3.8756947 ] [ 3.9494537 1.4690811 3.2057405 ] [ 3.3393293 4.5623531 0.8051226 ] [ 4.4417395 6.4369523 0.5320252 ] [ 3.5840033 1.1346742 5.3594437 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6956871e-10 3.016242e-10 2.240288e-10 ] [ 1.7687875e-10 2.3153491e-10 5.8061023e-10 ] [ 1.2218316e-10 3.2417543e-10 3.8756947e-10 ] [ 3.9494537e-10 1.4690811e-10 3.2057405e-10 ] [ 3.3393293e-10 4.5623531e-10 8.051226e-11 ] [ 4.4417395e-10 6.4369523e-10 5.320252e-11 ] [ 3.5840033e-10 1.1346742e-10 5.3594437e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1468071 0.3589821 -0.3573146 ] [ -0.0583217 -0.0045437 -0.1375152 ] [ -0.1136416 -0.0325743 0.3415533 ] [ 0.1221391 -0.1818572 0.27826 ] [ -0.1516479 -0.2947079 0.1472692 ] [ 0.0821774 0.1780685 -0.1286277 ] [ -0.0275123 -0.0233675 -0.143625 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.352109033874477e-10 5.751527279056877e-10 -5.724810983905037e-10 ] [ -9.344166422531137e-11 -7.27980991192896e-12 -2.203236384446362e-10 ] [ -1.820739146703053e-10 -5.218978189892544e-11 5.472287120170886e-10 ] [ 1.956884105055533e-10 -2.913673541641498e-10 4.45821666503808e-10 ] [ -2.429667199734163e-10 -4.721741073450644e-10 2.359512692039194e-10 ] [ 1.316627090381299e-10 2.852971876009248e-10 -2.060842937272762e-10 ] [ -4.407956384443584e-11 -3.743886218654401e-11 -2.301126171624e-10 ] ] } "relaxed-potential-energy" { "source-value" -16.373797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.623371474712518e-18 } }