{ "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" [ [ 1.047673 1.456203 2.59416 ] [ 0.648425 2.408552 0.8864435 ] [ 2.028254 0.9559849 0.3097335 ] [ 1.556479 0.0798405 1.221415 ] [ 2.621496 2.506538 1.825694 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.047673e-10 1.456203e-10 2.59416e-10 ] [ 6.48425e-11 2.408552e-10 8.864435000000001e-11 ] [ 2.028254e-10 9.559849e-11 3.097335e-11 ] [ 1.556479e-10 7.98405e-12 1.221415e-10 ] [ 2.621496e-10 2.506538e-10 1.825694e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.6579611 -0.4815723 34.0076524 ] [ -22.7006754 23.3141552 -12.8639239 ] [ 38.0365072 35.225582 -74.7108068 ] [ -25.2517392 -79.8206595 44.8422918 ] [ 23.5738685 21.7624946 8.7247866 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.188246596221585e-08 -7.715638802848839e-10 5.4486265603573e-08 ] [ -3.637049140224969e-08 3.735339439514275e-08 -2.061027812433036e-08 ] [ 6.094120257273088e-08 5.643760393447331e-08 -1.196999079760657e-07 ] [ -4.04577461807789e-08 -1.278867945077374e-07 7.184527154505155e-08 ] [ 3.776950097251357e-08 3.486736005840624e-08 1.397864911198912e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 36.146123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.791247320316117e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.901498 1.6110758 2.8600592 ] [ 0.1471739 2.447434 0.6315703 ] [ 2.2594383 1.3517668 -0.1250784 ] [ 1.4877389 -0.3910004 1.4879598 ] [ 3.1064779 2.3878421 1.9829351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.014980000000001e-11 1.6110758e-10 2.8600592e-10 ] [ 1.471739e-11 2.447434e-10 6.315703000000001e-11 ] [ 2.2594383e-10 1.3517668e-10 -1.250784e-11 ] [ 1.4877389e-10 -3.910004e-11 1.4879598e-10 ] [ 3.1064779e-10 2.3878421e-10 1.9829351e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 7.2e-06 2.6e-06 ] [ 7.2e-06 -6.7e-06 2.3e-06 ] [ -6.2e-06 3.4e-06 -4.1e-06 ] [ 1.21e-05 1.35e-05 3e-07 ] [ -5.5e-06 -1.74e-05 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.233675998016e-14 1.153567166976e-14 4.16565921408e-15 ] [ 1.153567166976e-14 -1.073458335936e-14 3.68500622784e-15 ] [ -9.93349504896e-15 5.44740051072e-15 -6.568924145279999e-15 ] [ 1.938633711168e-14 2.16293843808e-14 4.8065298624e-16 ] [ -8.8119714144e-15 -2.787787320192e-14 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }