{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4091439 -8.9513761 -3.8964915 ] [ -20.4281758 5.2200051 1.715489 ] [ -1.2552393 -3.9796612 17.0998797 ] [ 8.4725695 0.8532863 1.9407402 ] [ 16.6199895 6.8577459 -16.8596175 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.462050653522933e-09 -1.434168551140788e-08 -6.242867584445924e-09 ] [ -3.272954567235234e-08 8.363370131676766e-09 2.748516369039571e-09 ] [ -2.011115059969357e-09 -6.376120133344873e-09 2.739702747383252e-08 ] [ 1.357455277100315e-08 1.367115360708935e-09 3.109408575486716e-09 ] [ 2.662815861484148e-08 1.098732015236706e-08 -2.701208499413054e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.1369118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.025886747471646e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0444239 -0.0244371 0.8080745 ] [ 0.1029359 2.1504607 1.0651439 ] [ 1.1887548 2.0116296 3.1827823 ] [ 2.9060877 1.052825 1.8358836 ] [ 2.2803532 2.8177388 0.3606825 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0444239e-10 -2.44371e-12 8.080745e-11 ] [ 1.029359e-11 2.1504607e-10 1.0651439e-10 ] [ 1.1887548e-10 2.0116296e-10 3.1827823e-10 ] [ 2.9060877e-10 1.052825e-10 1.8358836e-10 ] [ 2.2803532e-10 2.8177388e-10 3.606825e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.22e-05 -6.8e-06 -1.8e-06 ] [ -5.8e-06 1.01e-05 -2.6e-06 ] [ 6.9e-06 2.6e-06 1.6e-06 ] [ -1.49e-05 1.03e-05 -1.19e-05 ] [ 1.6e-06 -1.63e-05 1.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.954655477376e-14 -1.089480102144e-14 -2.88391791744e-15 ] [ -9.292624400640001e-15 1.618198387008e-14 -4.16565921408e-15 ] [ 1.105501868352e-14 4.16565921408e-15 2.56348259328e-15 ] [ -2.387243164992e-14 1.650241919424e-14 -1.906590178752e-14 ] [ 2.56348259328e-15 -2.611547891904e-14 2.371221398784e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.103084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.259563146597855e-18 } }