{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3126518 0.5217928 0.1846885 ] [ 0.8333114 2.588069 2.680495 ] [ 2.642381 0.0430457 2.992394 ] [ 2.45603 2.243401 1.184533 ] [ 2.245972 1.834771 2.762862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.126518e-11 5.217928e-11 1.846885e-11 ] [ 8.333114000000001e-11 2.588069e-10 2.680495e-10 ] [ 2.642381e-10 4.30457e-12 2.992394e-10 ] [ 2.45603e-10 2.243401e-10 1.184533e-10 ] [ 2.245972e-10 1.834771e-10 2.762862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1207393 1.7872226 1.7639002 ] [ -33.1645262 17.0578825 -3.8650033 ] [ 4.3498483 -17.8434438 2.0936512 ] [ 2.9041101 7.4468459 -31.5279872 ] [ 24.7898285 -8.4485072 31.5354391 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.795622304471758e-09 2.86344626588539e-09 2.826079661864444e-09 ] [ -5.313542851754906e-08 2.732974054185346e-08 -6.192417926574849e-09 ] [ 6.969225250286625e-09 -2.858834849091871e-08 3.354399004749865e-09 ] [ 4.65289730644915e-09 1.193116239968033e-08 -5.051340399272166e-08 ] [ 3.971768365634153e-08 -1.353600071650047e-08 5.05253432526822e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.7898803 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.408294071629049e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1984218 1.7063842 0.1991612 ] [ 0.0505396 2.0018502 2.7353186 ] [ 2.9843895 -0.2370874 3.6369442 ] [ 2.7478678 1.7384312 0.4004847 ] [ 2.5091274 2.0215012 2.8330639 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.984218e-11 1.7063842e-10 1.991612e-11 ] [ 5.05396e-12 2.0018502e-10 2.7353186e-10 ] [ 2.9843895e-10 -2.370874e-11 3.6369442e-10 ] [ 2.7478678e-10 1.7384312e-10 4.004847e-11 ] [ 2.5091274e-10 2.0215012e-10 2.8330639e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.19e-05 8e-07 2.3e-06 ] [ 8.2e-06 2.1e-06 -5.9e-06 ] [ 1.11e-05 -3.47e-05 7.9e-06 ] [ 1.06e-05 -4.4e-06 3.1e-06 ] [ -1.81e-05 3.62e-05 -7.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.906590178752e-14 1.28174129664e-15 3.68500622784e-15 ] [ 1.313784829056e-14 3.36457090368e-15 -9.45284206272e-15 ] [ 1.778416049088e-14 -5.559552874176001e-14 1.265719530432e-14 ] [ 1.698307218048e-14 -7.04957713152e-15 4.96674752448e-15 ] [ -2.899939683648e-14 5.799879367296e-14 -1.2016324656e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.649402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.866439953070076e-18 } }