{ "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" [ [ 1.84187 2.347102 1.383115 ] [ 2.042679 1.03426 3.627522 ] [ 0.9834518 3.478775 3.226301 ] [ 4.103178 1.51668 2.106844 ] [ 3.482715 3.397853 2.716774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84187e-10 2.347102e-10 1.383115e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ 9.834518e-11 3.478775e-10 3.226301e-10 ] [ 4.103178e-10 1.51668e-10 2.106844e-10 ] [ 3.482715e-10 3.397853e-10 2.716774e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9690763 -1.9436155 -4.2032598 ] [ 2.6737827 6.8487713 -2.7170638 ] [ -1.2804483 -0.3082348 2.2775236 ] [ 3.3779076 -4.3585557 -0.1637653 ] [ -0.8021657 -0.2383653 4.8065653 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.359161254031367e-09 -3.114015313924503e-09 -6.734364582708483e-09 ] [ 4.2838721310395e-09 1.097294125806602e-08 -4.353216097582008e-09 ] [ -2.051504330403105e-09 -4.938465902769638e-10 3.648995065240251e-09 ] [ 5.412004583942637e-09 -6.983176042994579e-09 -2.623809349582983e-10 ] [ -1.285211130547667e-09 -3.819033108699783e-10 7.700966550008539e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.517617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.165760992632863e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8815065 2.2785894 1.2551612 ] [ 2.1891657 1.3045105 3.6240365 ] [ 0.8615835 3.4671523 3.2810492 ] [ 4.1199764 1.2427161 1.9431771 ] [ 3.4016618 3.4817017 2.9571319 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8815065e-10 2.2785894e-10 1.2551612e-10 ] [ 2.1891657e-10 1.3045105e-10 3.6240365e-10 ] [ 8.615835e-11 3.4671523e-10 3.2810492e-10 ] [ 4.1199764e-10 1.2427161e-10 1.9431771e-10 ] [ 3.4016618e-10 3.4817017e-10 2.9571319e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.4e-06 -7e-07 1.1e-06 ] [ 1.04e-05 2.3e-06 3.2e-06 ] [ -7.3e-06 -1e-06 -8e-06 ] [ -1.48e-05 7.9e-06 -1.2e-06 ] [ 8.3e-06 -8.5e-06 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.44740051072e-15 -1.12152363456e-15 1.76239428288e-15 ] [ 1.666263685632e-14 3.68500622784e-15 5.126965186560001e-15 ] [ -1.169588933184e-14 -1.6021766208e-15 -1.28174129664e-14 ] [ -2.371221398784e-14 1.265719530432e-14 -1.92261194496e-15 ] [ 1.329806595264e-14 -1.36185012768e-14 7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.58241519397267e-18 } }