{ "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" [ [ 0.8784497 0.4697805 1.02237 ] [ 0.3714623 2.027429 0.7033507 ] [ 0.1687176 1.823848 2.813644 ] [ 2.523837 0.1233038 2.780688 ] [ 2.720424 2.179791 0.2128499 ] [ 1.955613 2.373981 2.741889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.784497e-11 4.697805e-11 1.02237e-10 ] [ 3.714623e-11 2.027429e-10 7.033507e-11 ] [ 1.687176e-11 1.823848e-10 2.813644e-10 ] [ 2.523837e-10 1.233038e-11 2.780688e-10 ] [ 2.720424e-10 2.179791e-10 2.128499e-11 ] [ 1.955613e-10 2.373981e-10 2.741889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 203.9867903 -634.8737484 120.714382 ] [ -200.8121947 622.5713955 -121.6316491 ] [ -218.4432584 -57.5484999 5.4830936 ] [ 0.0841564 -0.3113164 -1.7698957 ] [ -4.5377762 2.2916827 3.3458236 ] [ 219.7222825 67.8704865 -6.1417544 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.268228690633178e-07 -1.017179885226475e-06 1.934057622281502e-07 ] [ -3.217366061705986e-07 9.974693428668727e-07 -1.948753861429071e-07 ] [ -3.499846844633042e-07 -9.220286186153134e-08 8.784884447954942e-09 ] [ 1.348334176815576e-10 -4.987838618609976e-10 -2.835685535157074e-09 ] [ -7.27031899796131e-09 3.671680474482032e-09 5.360600393405762e-09 ] [ 3.520339069906471e-07 1.087405076085124e-07 -9.840175391446688e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 144.31436 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.312170955426642e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.0802206 0.1667213 1.1444961 ] [ -0.1424247 2.4279991 0.1237286 ] [ -0.0800369 2.013969 2.7067171 ] [ 2.833348 -0.23366 2.9944635 ] [ 2.4611756 2.3317651 0.366967 ] [ 2.4662209 2.2913388 2.9384193 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0802206e-10 1.667213e-11 1.1444961e-10 ] [ -1.424247e-11 2.4279991e-10 1.237286e-11 ] [ -8.003689999999999e-12 2.013969e-10 2.7067171e-10 ] [ 2.833348e-10 -2.3366e-11 2.9944635e-10 ] [ 2.4611756e-10 2.3317651e-10 3.66967e-11 ] [ 2.4662209e-10 2.2913388e-10 2.9384193e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.31e-05 -1.1e-06 4.1e-06 ] [ -8.1e-06 -2.12e-05 -2.62e-05 ] [ 1.46e-05 3.2e-05 -1.36e-05 ] [ 2.8e-05 -6.9e-06 -1.68e-05 ] [ -1.11e-05 7.4e-06 1.63e-05 ] [ -4e-07 -1.03e-05 3.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.70102802454e-14 -1.7623942974e-15 6.568924199399999e-15 ] [ -1.29776307354e-14 -3.39661446408e-14 -4.197702781079999e-14 ] [ 2.33917788564e-14 5.126965228799999e-14 -2.17896022224e-14 ] [ 4.486094575199999e-14 -1.10550187746e-14 -2.691656745119999e-14 ] [ -1.77841606374e-14 1.18561070916e-14 2.61154791342e-14 ] [ -6.408706536e-16 -1.65024193302e-14 5.799879415079998e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.401793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268727603630476e-18 } }