{ "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" [ [ 0.0221122 0.00357 0.1110342 ] [ 0.2725629 2.182164 0.260904 ] [ 0.3472204 2.881652 2.59775 ] [ 1.734388 0.2655593 2.566686 ] [ 2.338795 2.363947 0.0295877 ] [ 1.600298 1.908592 1.497057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.21122e-12 3.57e-13 1.110342e-11 ] [ 2.725629e-11 2.182164e-10 2.60904e-11 ] [ 3.472204e-11 2.881652e-10 2.59775e-10 ] [ 1.734388e-10 2.655593e-11 2.566686e-10 ] [ 2.338795e-10 2.363947e-10 2.95877e-12 ] [ 1.600298e-10 1.908592e-10 1.497057e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.674898 -2.5744251 -1.8573305 ] [ -47.4777355 -3.6629702 -12.797794 ] [ -11.2919721 15.4261762 12.5194713 ] [ 3.2520023 -19.6879032 6.7740357 ] [ 59.8719979 19.1984684 -55.4415759 ] [ -2.6793946 -8.6993461 50.8031934 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.683482417824679e-09 -4.124683707220703e-09 -2.975771504198774e-09 ] [ -7.60677178266262e-08 -5.868725217127101e-09 -2.050432634461452e-08 ] [ -1.809173370134588e-08 2.471545885598139e-08 2.005840422163658e-08 ] [ 5.210282055847828e-09 -3.154349821961351e-08 1.085320162700456e-08 ] [ 9.592551527596669e-08 3.075933722564758e-08 -8.882719672728871e-08 ] [ -4.292863386017768e-09 -1.393788893766766e-08 8.139568872746087e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.866119 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.022685478703068e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1786936 -0.7718745 0.4496095 ] [ -0.4255435 1.7024857 -0.288215 ] [ 0.5883753 3.5999999 3.09282 ] [ 1.6820373 -0.1360662 2.1410969 ] [ 3.3023654 3.0429294 0.3166481 ] [ 1.3468356 2.16801 1.3510593 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.786936e-11 -7.718745000000001e-11 4.496095e-11 ] [ -4.255435e-11 1.7024857e-10 -2.88215e-11 ] [ 5.883753000000001e-11 3.5999999e-10 3.09282e-10 ] [ 1.6820373e-10 -1.360662e-11 2.1410969e-10 ] [ 3.3023654e-10 3.0429294e-10 3.166481e-11 ] [ 1.3468356e-10 2.16801e-10 1.3510593e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.81e-05 2.65e-05 -2.18e-05 ] [ -1.66e-05 -3.45e-05 -6.2e-06 ] [ -2.2e-06 8.9e-06 8.8e-06 ] [ 1.73e-05 2.13e-05 8.1e-06 ] [ 1.22e-05 3.8e-06 2e-07 ] [ 7.2e-06 -2.61e-05 1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.899939683648e-14 4.24576804512e-14 -3.492745033344e-14 ] [ -2.659613190528e-14 -5.52750934176e-14 -9.93349504896e-15 ] [ -3.52478856576e-15 1.425937192512e-14 1.409915426304e-14 ] [ 2.771765553984e-14 3.412636202304e-14 1.297763062848e-14 ] [ 1.954655477376e-14 6.08827115904e-15 3.2043532416e-16 ] [ 1.153567166976e-14 -4.181680980288e-14 1.730350750464e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.408087 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.789083000425241e-18 } }