{ "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" [ [ 2.965438 2.618572 1.194827 ] [ 1.728438 2.327042 2.925955 ] [ 2.189414 4.329945 2.407266 ] [ 3.949135 1.445792 2.998392 ] [ 4.502281 4.108784 2.139004 ] [ 4.146323 3.387836 4.449004 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.965438e-10 2.618572e-10 1.194827e-10 ] [ 1.728438e-10 2.327042e-10 2.925955e-10 ] [ 2.189414e-10 4.329945000000001e-10 2.407266e-10 ] [ 3.949135e-10 1.445792e-10 2.998392e-10 ] [ 4.502281e-10 4.108784e-10 2.139004e-10 ] [ 4.146323e-10 3.387836e-10 4.449004000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.123831 -2.4752804 -6.638184 ] [ -3.8875323 -3.2276647 3.9934994 ] [ -1.6891362 5.9313929 1.4038334 ] [ 1.3405874 -1.3610055 1.6522124 ] [ 2.2290644 1.4439128 0.7147024 ] [ -0.1168142 -0.3113551 -1.1260636 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.402752374730285e-09 -3.965836386804472e-09 -1.063554320936863e-08 ] [ -6.228513363664852e-09 -5.171288922121446e-09 6.398291373858828e-09 ] [ -2.706294528986953e-09 9.503139033159112e-09 2.249189052978174e-09 ] [ 2.147857790419058e-09 -2.180571192880215e-09 2.647136079875858e-09 ] [ 3.57135486793758e-09 2.313403330633866e-09 1.14507947610965e-09 ] [ -1.871569802174554e-10 -4.98845861986846e-10 -1.804152773453883e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.550268 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.369903949117438e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.5278416 2.263427 1.0680457 ] [ 1.5646567 2.3761759 2.5191678 ] [ 2.234651 4.4261955 3.2662965 ] [ 3.6430118 1.3943619 3.3492838 ] [ 4.1978808 4.3134326 1.8152028 ] [ 4.3129871 3.4443781 4.0964515 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.5278416e-10 2.263427e-10 1.0680457e-10 ] [ 1.5646567e-10 2.3761759e-10 2.5191678e-10 ] [ 2.234651e-10 4.4261955e-10 3.2662965e-10 ] [ 3.6430118e-10 1.3943619e-10 3.3492838e-10 ] [ 4.1978808e-10 4.3134326e-10 1.8152028e-10 ] [ 4.3129871e-10 3.4443781e-10 4.0964515e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.94e-05 4.68e-05 -3.69e-05 ] [ -6.14e-05 -9.9e-06 -5.1e-06 ] [ 5e-05 1.37e-05 4.9e-06 ] [ 8.7e-06 -1.51e-05 4.76e-05 ] [ -5.73e-05 -4.07e-05 1.19e-05 ] [ 5e-07 5.1e-06 -2.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.516929127552e-14 7.498186585344001e-14 -5.912031730752001e-14 ] [ -9.837364451712e-14 -1.586154854592e-14 -8.17110076608e-15 ] [ 8.010883104e-14 2.194981970496e-14 7.850665441919999e-15 ] [ 1.393893660096e-14 -2.419286697408e-14 7.626360715008e-14 ] [ -9.180472037184001e-14 -6.520858846656e-14 1.906590178752e-14 ] [ 8.010883104e-16 8.17110076608e-15 -3.588875630592e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.567729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853354495955016e-18 } }