{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6348472 4.3104982 -5.0512433 ] [ -0.5080824 1.1612525 1.0942689 ] [ 6.1425476 -11.7311608 -0.3591048 ] [ 0.3272081 -1.9978874 0.95072 ] [ 2.6731738 8.2572975 3.3653591 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.383455030802034e-08 6.906179440040482e-09 -8.092983921232641e-09 ] [ -8.14037742719954e-10 1.860531606345552e-09 1.753212048448533e-09 ] [ 9.84144615687115e-09 -1.879539156860542e-08 -5.753493149770598e-10 ] [ 5.242451679563885e-10 -3.200968483270898e-09 1.523221356926976e-09 ] [ 4.282896565695095e-09 1.322964900549029e-08 5.391899670616529e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.7052083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.394728121745411e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0425178 2.134785 0.1922226 ] [ 0.1973035 2.1440719 2.4897976 ] [ 2.454928 0.1932702 0.6707144 ] [ 1.499724 0.1043021 2.9371571 ] [ 2.9246047 3.544614 1.0161666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0425178e-10 2.134785e-10 1.922226e-11 ] [ 1.973035e-11 2.1440719e-10 2.4897976e-10 ] [ 2.454928e-10 1.932702e-11 6.707144000000001e-11 ] [ 1.499724e-10 1.043021e-11 2.9371571e-10 ] [ 2.9246047e-10 3.544614e-10 1.0161666e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 1.1e-06 -6e-07 ] [ -4.9e-06 -1.2e-06 2.3e-06 ] [ 3e-06 7.2e-06 1.3e-06 ] [ -1.3e-06 -4.7e-06 2.1e-06 ] [ 5.5e-06 -2.4e-06 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 1.76239428288e-15 -9.6130597248e-16 ] [ -7.850665441919999e-15 -1.92261194496e-15 3.68500622784e-15 ] [ 4.8065298624e-15 1.153567166976e-14 2.08282960704e-15 ] [ -2.08282960704e-15 -7.53023011776e-15 3.36457090368e-15 ] [ 8.8119714144e-15 -3.84522388992e-15 -8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.027456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927010881090069e-18 } }