{ "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" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -39.0648278 -19.1328809 3.5632791 ] [ -5.2812976 14.1622329 -14.4939152 ] [ -1.7333263 18.4150793 20.4791042 ] [ 12.9078336 -6.675219 -30.2273277 ] [ 30.4205392 -12.1676376 20.8793879 ] [ 2.7510788 5.3984252 -0.2005282 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.25887537967379e-08 -3.065425446653086e-08 5.709002467405266e-09 ] [ -8.461571542207151e-09 2.269039845070458e-08 -2.322181207729776e-08 ] [ -2.777094874077768e-09 2.950420952463803e-08 3.281114196416709e-08 ] [ 2.06806292190967e-08 -1.069487982051996e-08 -4.842951775020023e-08 ] [ 4.873907669836993e-08 -1.949470449308702e-08 3.345246714999441e-08 ] [ 4.407714135338519e-09 8.649230644577565e-09 -3.212815938511066e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 16.542064 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.650330820057733e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.7928226 1.8572736 1.8852666 ] [ -1.3477312 2.7417458 -0.0508342 ] [ 0.8718086 0.9640624 3.0217541 ] [ 4.1126271 1.4378014 0.6949384 ] [ 2.9857736 0.7388576 2.4522439 ] [ 3.9261269 2.6427874 -1.1375354 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.928226000000001e-11 1.8572736e-10 1.8852666e-10 ] [ -1.3477312e-10 2.7417458e-10 -5.08342e-12 ] [ 8.718086000000001e-11 9.640624000000001e-11 3.0217541e-10 ] [ 4.1126271e-10 1.4378014e-10 6.949384e-11 ] [ 2.9857736e-10 7.388576e-11 2.4522439e-10 ] [ 3.9261269e-10 2.6427874e-10 -1.1375354e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.2810638 -0.2338563 0.3457589 ] [ -0.1431053 0.0635236 -0.0624965 ] [ -0.4501746 0.1959991 -0.2379233 ] [ 0.0379255 0.05482 -0.069727 ] [ 0.1429145 -0.0243074 0.007931 ] [ 0.1313761 -0.0561789 0.0164568 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.50313849313207e-10 -3.746790964867911e-10 5.539668260135251e-10 ] [ -2.292799659725702e-10 1.017760267890509e-10 -1.001304311818272e-10 ] [ -7.212592193979917e-10 3.140251757178413e-10 -3.811951488035846e-10 ] [ 6.07633494321504e-11 8.783132235225601e-11 -1.117149692385216e-10 ] [ 2.289742706733216e-10 -3.894474799243392e-11 1.27068627795648e-11 ] [ 2.104877159518829e-10 -9.000852016226111e-11 2.636670021318144e-11 ] ] } "relaxed-potential-energy" { "source-value" -13.568473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.173909022055604e-18 } }