{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2473971 -0.5389827 -0.8225118 ] [ -0.5504324 -0.4133416 0.5220703 ] [ 0.6317759 0.8256025 1.1540123 ] [ -0.0474092 -3.014312 -1.2118379 ] [ 1.2172979 -2.1685988 -0.7012736 ] [ 0.0004272 2.9500583 0.3639379 ] [ -1.4990565 2.3595742 0.6956028 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.963738496737197e-10 -8.635454809556603e-10 -1.317809176292126e-09 ] [ -8.81889922610834e-10 -6.622462479240653e-10 8.364488290740421e-10 ] [ 1.012216576564879e-09 1.322761023574032e-09 1.848931527175636e-09 ] [ -7.595791185083135e-11 -4.829460214196889e-09 -1.941578351579368e-09 ] [ 1.950326235928936e-09 -3.474478297254935e-09 -1.123564166704251e-09 ] [ 6.8444985240576e-13 4.726514438256993e-09 5.830927948030483e-10 ] [ -2.401753277558275e-09 3.780454618282864e-09 1.114478543523018e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.470138 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.760330639054967e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1404244 2.3504748 1.2747322 ] [ 2.2697684 1.4010616 3.4719062 ] [ 2.1509037 3.787576 3.2818283 ] [ 4.4826667 1.8630469 1.1262775 ] [ 4.6256244 1.4311165 3.4382234 ] [ 3.8277279 4.137659 1.5043211 ] [ 4.4964865 3.7596443 3.7749124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1404244e-10 2.3504748e-10 1.2747322e-10 ] [ 2.2697684e-10 1.4010616e-10 3.4719062e-10 ] [ 2.1509037e-10 3.787576e-10 3.2818283e-10 ] [ 4.4826667e-10 1.8630469e-10 1.1262775e-10 ] [ 4.625624400000001e-10 1.4311165e-10 3.4382234e-10 ] [ 3.8277279e-10 4.137659e-10 1.5043211e-10 ] [ 4.4964865e-10 3.7596443e-10 3.7749124e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.55e-05 -4.7e-06 9.1e-06 ] [ 5.9e-06 3.54e-05 1.83e-05 ] [ -3e-05 1.5e-06 -3.1e-05 ] [ -1.12e-05 2.3e-05 -2.66e-05 ] [ 2.42e-05 -5.16e-05 1.03e-05 ] [ 6.2e-06 -1.32e-05 4.58e-05 ] [ -1.07e-05 9.7e-06 -2.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.48337376224e-14 -7.53023011776e-15 1.457980724928e-14 ] [ 9.45284206272e-15 5.671705237632e-14 2.931983216064e-14 ] [ -4.8065298624e-14 2.4032649312e-15 -4.96674752448e-14 ] [ -1.794437815296e-14 3.68500622784e-14 -4.261789811328e-14 ] [ 3.877267422336e-14 -8.267231363328e-14 1.650241919424e-14 ] [ 9.93349504896e-15 -2.114873139456e-14 7.337968923264e-14 ] [ -1.714328984256e-14 1.554111322176e-14 -4.149637447872e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }