{ "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" [ [ 0.0066411 1.299857 0.8298456 ] [ 0.9999642 1.240181 2.737035 ] [ 2.654666 1.132969 0.0147569 ] [ 2.745471 0.2375767 2.196855 ] [ 1.997397 2.884463 1.181944 ] [ 2.106064 2.994709 2.966195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.6411e-13 1.299857e-10 8.298456e-11 ] [ 9.999642e-11 1.240181e-10 2.737035e-10 ] [ 2.654666e-10 1.132969e-10 1.47569e-12 ] [ 2.745471000000001e-10 2.375767e-11 2.196855e-10 ] [ 1.997397e-10 2.884463e-10 1.181944e-10 ] [ 2.106064e-10 2.994709e-10 2.966195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5804451 0.6208776 -2.5671321 ] [ -6.1334056 -3.7146817 4.0871966 ] [ 0.3918997 -1.5944158 -1.1992503 ] [ 3.935258 -2.3626181 -1.2421003 ] [ -1.4553423 0.8663703 -15.1058911 ] [ 3.8420354 6.1844678 16.0271772 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.299755688779182e-10 9.947555750984142e-10 -4.112999033125208e-09 ] [ -9.826799058203798e-09 -5.951576173453599e-09 6.54841083713325e-09 ] [ 6.278925370385338e-10 -2.554535718594128e-09 -1.921410793147387e-09 ] [ 6.304978364416167e-09 -3.785331483698917e-09 -1.990064061348666e-09 ] [ -2.3317154083213e-09 1.388078239615482e-09 -2.42023055567708e-08 ] [ 6.155619294165977e-09 9.90860972125041e-09 2.567836860725881e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.144406279081938 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.833540985041801e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2493462 1.4595724 0.6676442 ] [ 0.7156102 0.976673 2.9808154 ] [ 2.4676142 0.9955295 0.1234639 ] [ 2.9339725 0.5129405 2.4366801 ] [ 1.8388027 3.1638766 0.7023862 ] [ 2.3048575 2.6811638 3.0156416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.493462e-11 1.4595724e-10 6.676442e-11 ] [ 7.156102e-11 9.76673e-11 2.9808154e-10 ] [ 2.4676142e-10 9.955295e-11 1.234639e-11 ] [ 2.9339725e-10 5.129405e-11 2.4366801e-10 ] [ 1.8388027e-10 3.1638766e-10 7.023862e-11 ] [ 2.3048575e-10 2.681163800000001e-10 3.0156416e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.88e-05 -2.49e-05 -3.17e-05 ] [ -2.07e-05 3.71e-05 6.6e-06 ] [ -1.45e-05 6.46e-05 6.1e-06 ] [ -1.11e-05 -1.94e-05 6.6e-06 ] [ -3.86e-05 -5.82e-05 2.72e-05 ] [ 4.6e-05 8e-07 -1.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.216445288704e-14 -3.989419785791999e-14 -5.078899887936e-14 ] [ -3.316505605055999e-14 5.944075263168e-14 1.057436569728e-14 ] [ -2.32315610016e-14 1.0350060970368e-13 9.77327738688e-15 ] [ -1.778416049088e-14 -3.108222644352e-14 1.057436569728e-14 ] [ -6.184401756288e-14 -9.324667933055999e-14 4.357920408576e-14 ] [ 7.37001245568e-14 1.28174129664e-15 -2.355199632576e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.635338279081939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.063098386184439e-18 } }