{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -57.3359097 20.5340967 -37.7184767 ] [ -17.6496925 -5.90546 12.6309144 ] [ -70.3337346 -13.5363542 4.3773197 ] [ -9.0784753 32.8357429 14.3728453 ] [ 40.3353756 -31.4667133 -17.360002 ] [ 70.25773 -17.6175766 39.9395776 ] [ 43.8047065 15.1562645 -16.2421783 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.186225405363995e-08 3.289924966198643e-08 -6.043166154092953e-08 ] [ -2.82779246878091e-08 -9.461589947069567e-09 2.023695575100606e-08 ] [ -1.12687065229672e-07 -2.168763023010789e-08 7.01323928510727e-09 ] [ -1.454532087817027e-08 5.260865960097959e-08 2.302783671403516e-08 ] [ 6.462439577750678e-08 -5.041523238267642e-08 -2.781378934144125e-08 ] [ 1.125652924364788e-07 -2.822646934367315e-08 6.399025747534737e-08 ] [ 7.01828766353058e-08 2.4283012640561e-08 -2.602283834312509e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 28.43856 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.556359596121805e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3167147 1.3393518 2.6110672 ] [ 2.0168754 1.99002 5.1318706 ] [ 2.1173731 3.8430289 1.6172048 ] [ 2.878379 4.5502188 4.3570178 ] [ 3.9881646 1.357395 1.7391473 ] [ 4.7491572 2.0645754 4.4789597 ] [ 4.943389 4.0558521 2.3441896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3167147e-10 1.3393518e-10 2.6110672e-10 ] [ 2.0168754e-10 1.99002e-10 5.1318706e-10 ] [ 2.1173731e-10 3.8430289e-10 1.6172048e-10 ] [ 2.878379e-10 4.5502188e-10 4.357017800000001e-10 ] [ 3.9881646e-10 1.357395e-10 1.7391473e-10 ] [ 4.7491572e-10 2.0645754e-10 4.4789597e-10 ] [ 4.943389e-10 4.0558521e-10 2.3441896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.83e-05 -1.35e-05 2.08e-05 ] [ -2.05e-05 -3.78e-05 1.58e-05 ] [ 6.31e-05 -1.03e-05 9.1e-06 ] [ 2.1e-05 -3.11e-05 -3.94e-05 ] [ 8e-07 9.22e-05 2.89e-05 ] [ -8.4e-06 3.44e-05 -2.11e-05 ] [ -1.78e-05 -3.4e-05 -1.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.136336457664001e-14 -2.16293843808e-14 3.332527371264e-14 ] [ -3.28446207264e-14 -6.056227626623999e-14 2.531439060864e-14 ] [ 1.0109734477248e-13 -1.650241919424e-14 1.457980724928e-14 ] [ 3.36457090368e-14 -4.982769290688e-14 -6.312575885952001e-14 ] [ 1.28174129664e-15 1.4772068443776e-13 4.630290434112001e-14 ] [ -1.345828361472e-14 5.511487575552001e-14 -3.380592669888e-14 ] [ -2.851874385024e-14 -5.44740051072e-14 -2.24304726912e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.305738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.093120207089015e-18 } }