{ "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" [ [ -2.0146156 0.1903882 -2.1867621 ] [ -1.4415444 0.6423899 8.871662 ] [ -4.0713139 0.7560778 -1.7903458 ] [ -1.2046403 -5.8107264 -1.9244492 ] [ 3.619052 -0.5734534 -5.4085998 ] [ -2.2537176 3.9066687 0.3299026 ] [ 7.3667798 0.8886551 2.1085923 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.227770014218964e-09 3.050355229161946e-10 -3.503579111871512e-09 ] [ -2.309608735525163e-09 1.02922207921805e-09 1.421396944403977e-08 ] [ -6.522963946518068e-09 1.211370174665898e-09 -2.868450183907473e-09 ] [ -1.930046525133498e-09 -9.309809987945349e-09 -3.083307516157264e-09 ] [ 5.798360503859482e-09 -9.187736305982707e-10 -8.665532150823556e-09 ] [ -3.610853648605486e-09 6.259173256351129e-09 5.285622328611341e-10 ] [ 1.18028823661417e-08 1.423782425174686e-09 3.3783372858589e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.316033 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.696946268720129e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0399145 3.0810437 1.4577183 ] [ 2.7998447 3.2672536 5.0244479 ] [ 1.1224233 3.187749 3.5168109 ] [ 3.001113 1.4505919 3.2072246 ] [ 4.2843756 3.0945775 1.692766 ] [ 2.9991245 4.8855251 3.0283227 ] [ 4.7540365 3.2096652 3.8971266 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0399145e-10 3.0810437e-10 1.4577183e-10 ] [ 2.7998447e-10 3.2672536e-10 5.0244479e-10 ] [ 1.1224233e-10 3.187749e-10 3.5168109e-10 ] [ 3.001113e-10 1.4505919e-10 3.2072246e-10 ] [ 4.2843756e-10 3.0945775e-10 1.692766e-10 ] [ 2.9991245e-10 4.885525099999999e-10 3.0283227e-10 ] [ 4.7540365e-10 3.2096652e-10 3.8971266e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.63e-05 4.7e-06 -1.89e-05 ] [ 3.8e-06 -7.7e-06 6.7e-06 ] [ 4.9e-06 6.6e-06 -1.22e-05 ] [ 2e-07 -2.93e-05 1.37e-05 ] [ -1.52e-05 1.23e-05 4.1e-06 ] [ -6e-07 1.22e-05 -1.11e-05 ] [ 2.33e-05 1.1e-06 1.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.611547891904e-14 7.53023011776e-15 -3.028113813312e-14 ] [ 6.08827115904e-15 -1.233675998016e-14 1.073458335936e-14 ] [ 7.850665441919999e-15 1.057436569728e-14 -1.954655477376e-14 ] [ 3.2043532416e-16 -4.694377498944e-14 2.194981970496e-14 ] [ -2.435308463616e-14 1.970677243584e-14 6.568924145279999e-15 ] [ -9.6130597248e-16 1.954655477376e-14 -1.778416049088e-14 ] [ 3.733071526464e-14 1.76239428288e-15 2.835852618816e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.399964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.191046483556165e-18 } }