{ "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" [ [ 0.9949033 2.503274 2.364783 ] [ 2.081862 1.922853 4.128948 ] [ 3.003732 4.725891 2.729897 ] [ 1.175643 3.973335 4.072515 ] [ 3.741462 2.310355 2.499434 ] [ 3.610675 3.096222 4.683717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.949033000000001e-11 2.503274000000001e-10 2.364783e-10 ] [ 2.081862e-10 1.922853e-10 4.128948e-10 ] [ 3.003732e-10 4.725891e-10 2.729897e-10 ] [ 1.175643e-10 3.973335e-10 4.072515e-10 ] [ 3.741462e-10 2.310355e-10 2.499434e-10 ] [ 3.610675e-10 3.096222e-10 4.683717e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7103778 -0.0518001 -4.3459517 ] [ -4.1616199 -9.2441932 2.5976404 ] [ -0.0746138 -0.9064663 0.3821046 ] [ -1.393212 4.5178997 0.548869 ] [ 0.8221943 0.6916766 -2.6904821 ] [ 6.5176292 4.9928833 3.5078199 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.740327323895339e-09 -8.299290917510208e-11 -6.962982208866015e-09 ] [ -6.667650108436034e-09 -1.481083022319834e-08 4.16187871812556e-09 ] [ -1.19544485949047e-10 -1.452319113403079e-09 6.121990568201357e-10 ] [ -2.232171694218009e-09 7.238473274459334e-09 8.793850796818753e-10 ] [ 1.317300485215022e-09 1.108188077674433e-09 -4.310627519300888e-09 ] [ 1.044239312728341e-08 7.999480893642752e-09 5.620147033756994e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.137567 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.26508793223936e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2044853 2.1904527 2.6530962 ] [ 2.1610099 1.4618793 4.612529 ] [ 3.3436609 4.5176974 3.240823 ] [ 1.0150189 4.4215268 3.3027719 ] [ 3.2056358 2.8276865 1.6406751 ] [ 3.6784666 3.1126873 5.0293989 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2044853e-10 2.1904527e-10 2.6530962e-10 ] [ 2.1610099e-10 1.4618793e-10 4.612529e-10 ] [ 3.3436609e-10 4.517697400000001e-10 3.240823e-10 ] [ 1.0150189e-10 4.4215268e-10 3.3027719e-10 ] [ 3.2056358e-10 2.8276865e-10 1.6406751e-10 ] [ 3.6784666e-10 3.1126873e-10 5.0293989e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.6e-05 9.3e-06 -3.36e-05 ] [ 5.33e-05 -1.32e-05 2.31e-05 ] [ 1.59e-05 -7.9e-06 1.36e-05 ] [ -3.8e-06 9.9e-06 -3.61e-05 ] [ -2.9e-05 4.7e-06 4e-07 ] [ -5e-07 -2.8e-06 3.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.76783583488e-14 1.490024257344e-14 -5.383313445888e-14 ] [ 8.539601388864e-14 -2.114873139456e-14 3.701027994048e-14 ] [ 2.547460827072e-14 -1.265719530432e-14 2.178960204288e-14 ] [ -6.08827115904e-15 1.586154854592e-14 -5.783857601088001e-14 ] [ -4.64631220032e-14 7.53023011776e-15 6.408706483200001e-16 ] [ -8.010883104e-16 -4.48609453824e-15 5.239117550016001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.486326 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961835932168718e-18 } }