{ "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" [ [ 2.510917 2.898515 1.87318 ] [ 1.068289 2.930408 3.679489 ] [ 1.738918 4.773151 2.611531 ] [ 3.136153 2.016935 3.60422 ] [ 3.930075 4.659698 3.066974 ] [ 4.662989 3.229538 1.53666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.510917e-10 2.898515000000001e-10 1.87318e-10 ] [ 1.068289e-10 2.930408e-10 3.679489e-10 ] [ 1.738918e-10 4.773151000000001e-10 2.611531e-10 ] [ 3.136153000000001e-10 2.016935e-10 3.604220000000001e-10 ] [ 3.930075e-10 4.659698e-10 3.066974e-10 ] [ 4.662989e-10 3.229538e-10 1.53666e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.8502953 4.0689031 -94.3365752 ] [ -36.0214377 -8.9987377 34.042925 ] [ -15.2187345 35.9150363 -3.178195 ] [ 31.8099716 -37.4574324 61.8761931 ] [ 7.7519832 17.3373552 20.0463551 ] [ 21.5285127 -10.8651245 -18.4507029 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.578191283763613e-08 6.519101419120644e-09 -1.511438552717811e-07 ] [ -5.771270533054373e-08 -1.441756715965156e-08 5.454277853864784e-08 ] [ -2.438310061406238e-08 5.754223149504333e-08 -5.092029725343456e-09 ] [ 5.096519280583198e-08 -6.001342246647644e-08 9.913658996892628e-08 ] [ 1.242004624787437e-08 2.777750516794531e-08 3.211780147347484e-08 ] [ 3.449247972853588e-08 -1.740784845598129e-08 -2.956128482370676e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.231862 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.639325008365193e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4333379 2.5813195 1.5625534 ] [ 0.6920668 2.8471188 3.6950417 ] [ 1.7719563 4.9650059 2.6016236 ] [ 3.1883877 2.178486 4.1055127 ] [ 4.173254 4.4315993 3.3521492 ] [ 4.7883384 3.5047155 1.0551735 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4333379e-10 2.5813195e-10 1.5625534e-10 ] [ 6.920668e-11 2.8471188e-10 3.6950417e-10 ] [ 1.7719563e-10 4.9650059e-10 2.6016236e-10 ] [ 3.1883877e-10 2.178486e-10 4.1055127e-10 ] [ 4.173254e-10 4.4315993e-10 3.3521492e-10 ] [ 4.7883384e-10 3.5047155e-10 1.0551735e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.41e-05 1.33e-05 2.9e-06 ] [ 2.1e-05 1.36e-05 -2.6e-06 ] [ -2.39e-05 -2.66e-05 2.76e-05 ] [ -1.29e-05 2.18e-05 -5.3e-06 ] [ -1.38e-05 -1.68e-05 -1.83e-05 ] [ 4.38e-05 -5.3e-06 -4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.259069035328e-14 2.130894905664e-14 4.646312200320001e-15 ] [ 3.36457090368e-14 2.178960204288e-14 -4.16565921408e-15 ] [ -3.829202123712e-14 -4.261789811328e-14 4.422007473408001e-14 ] [ -2.066807840832e-14 3.492745033344e-14 -8.491536090240001e-15 ] [ -2.211003736704e-14 -2.691656722944e-14 -2.931983216064e-14 ] [ 7.017533599104001e-14 -8.491536090240001e-15 -7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.401793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.26872757670011e-18 } }