{ "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" [ [ -8.7872543 -7.4474332 -2.5754765 ] [ -7.3776485 -1.6912881 8.3578948 ] [ -12.1001325 9.6967753 -11.5618539 ] [ -1.5654118 9.7104737 6.055064 ] [ 4.6413456 -7.867107 -9.8598786 ] [ 14.8593005 -10.0261312 13.7774282 ] [ 10.329801 7.6247106 -4.193178 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.407873340048427e-08 -1.193210335800973e-08 -4.126368235719812e-09 ] [ -1.182029594318019e-08 -2.709742252857253e-09 1.339082364766589e-08 ] [ -1.938654940008226e-08 1.553594668281091e-08 -1.85241320116853e-08 ] [ -2.508066187884446e-09 1.555789393903327e-08 9.70128197824773e-09 ] [ 7.43625540937295e-09 -1.260449490873203e-08 -1.579726697684623e-08 ] [ 2.380722386254175e-08 -1.606363300571345e-08 2.207387335679062e-08 ] [ 1.655016565971646e-08 1.221613306368594e-08 -6.718211758452902e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1106159 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.585932692068751e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7315305 1.6586908 2.5588296 ] [ 2.3732335 2.2297348 4.8267993 ] [ 1.9909982 3.936465 1.8607647 ] [ 2.6581671 4.5299943 4.2181061 ] [ 4.0153593 1.2374611 1.9675792 ] [ 4.6823351 1.8307639 4.3250407 ] [ 4.5584293 3.7773321 2.5223375 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7315305e-10 1.6586908e-10 2.5588296e-10 ] [ 2.3732335e-10 2.2297348e-10 4.8267993e-10 ] [ 1.9909982e-10 3.936465e-10 1.8607647e-10 ] [ 2.6581671e-10 4.5299943e-10 4.2181061e-10 ] [ 4.0153593e-10 1.2374611e-10 1.9675792e-10 ] [ 4.682335100000001e-10 1.8307639e-10 4.3250407e-10 ] [ 4.5584293e-10 3.7773321e-10 2.5223375e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.7e-06 8.9e-06 -1.28e-05 ] [ 2.49e-05 -1.14e-05 -3.36e-05 ] [ 1.21e-05 3.9e-06 -3.13e-05 ] [ -5.8e-06 1.53e-05 6.14e-05 ] [ -1.37e-05 -6e-07 3.18e-05 ] [ 3.6e-06 3.98e-05 -1.55e-05 ] [ -3.09e-05 -5.59e-05 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.554111322176e-14 1.425937192512e-14 -2.050786074624e-14 ] [ 3.989419785791999e-14 -1.826481347712e-14 -5.383313445888e-14 ] [ 1.938633711168e-14 6.24848882112e-15 -5.014812823104e-14 ] [ -9.292624400640001e-15 2.451330229824e-14 9.837364451712e-14 ] [ -2.194981970496e-14 -9.6130597248e-16 5.094921654144e-14 ] [ 5.76783583488e-15 6.376662950784e-14 -2.48337376224e-14 ] [ -4.950725758272e-14 -8.956167310272e-14 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.765666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846373471814145e-18 } }