{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3531094 -1.6450219 -1.026936 ] [ -0.5060757 -2.6676891 4.0546414 ] [ -1.4629528 3.5130576 -3.0470944 ] [ 0.6248232 0.4774771 -0.1057047 ] [ 0.4357186 -0.116689 -0.4382684 ] [ -0.7208182 -1.1788848 0.9143837 ] [ 1.2761956 1.61775 -0.3510217 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.657436252647155e-10 -2.635615628883995e-09 -1.645332850257869e-09 ] [ -8.108226548949946e-10 -4.274109107582993e-09 6.496251656807782e-09 ] [ -2.343908773493899e-09 5.628538754243757e-09 -4.881983409050604e-09 ] [ 1.001077123173443e-09 7.650026465873836e-10 -1.693575990486778e-10 ] [ 6.980981541677068e-10 -1.869563877045312e-10 -7.021833841154227e-10 ] [ -1.154878067887138e-09 -1.888781665176484e-09 1.465004186580601e-09 ] [ 2.044690753887828e-09 2.5919212282992e-09 -5.623987611334714e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.778869 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.528053501446588e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6495248 2.0683129 2.2109957 ] [ 2.7784991 2.0375512 4.5174352 ] [ 2.0228537 4.2439666 1.7515944 ] [ 4.8253145 2.7661706 2.1732613 ] [ 4.9018688 2.9453204 4.4502201 ] [ 4.2136857 4.9547472 1.9313139 ] [ 4.4960095 5.206953 4.2103354 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6495248e-10 2.0683129e-10 2.2109957e-10 ] [ 2.7784991e-10 2.0375512e-10 4.517435200000001e-10 ] [ 2.0228537e-10 4.243966600000001e-10 1.7515944e-10 ] [ 4.8253145e-10 2.7661706e-10 2.1732613e-10 ] [ 4.9018688e-10 2.9453204e-10 4.4502201e-10 ] [ 4.2136857e-10 4.9547472e-10 1.9313139e-10 ] [ 4.496009500000001e-10 5.206953e-10 4.2103354e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-07 -1e-07 1.31e-05 ] [ 2.33e-05 3.7e-06 -1.3e-06 ] [ 1.8e-06 1.7e-05 -1e-05 ] [ 4.9e-06 5.8e-06 9.9e-06 ] [ -1.54e-05 -1.35e-05 5.6e-06 ] [ -8.6e-06 4.3e-06 4.3e-06 ] [ -6.8e-06 -1.73e-05 -2.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-15 -1.6021766208e-16 2.098851373248e-14 ] [ 3.733071526464e-14 5.928053496960001e-15 -2.08282960704e-15 ] [ 2.88391791744e-15 2.72370025536e-14 -1.6021766208e-14 ] [ 7.850665441919999e-15 9.292624400640001e-15 1.586154854592e-14 ] [ -2.467351996032e-14 -2.16293843808e-14 8.972189076479999e-15 ] [ -1.377871893888e-14 6.889359469440001e-15 6.889359469440001e-15 ] [ -1.089480102144e-14 -2.771765553984e-14 -3.460701500928e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }