{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.0028639 -4.3443411 0.7307673 ] [ -3.7460127 4.2354268 -2.4226223 ] [ 3.1412171 -1.9858789 -6.4844412 ] [ 3.4557273 -2.9967541 4.8523426 ] [ 5.1519322 5.0915473 3.3239536 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.282200144002431e-08 -6.960401743200556e-09 1.17081828330514e-09 ] [ -6.001773969159884e-09 6.785901798069757e-09 -3.881468810088724e-09 ] [ 5.032784598477176e-09 -3.181728745320021e-09 -1.03892200895923e-08 ] [ 5.536685487920308e-09 -4.801329357306545e-09 7.774309869831886e-09 ] [ 8.25430532278671e-09 8.157558047757364e-09 5.325560746543995e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.4139349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.348060978571319e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2258166 2.108465 3.0584919 ] [ 3.1462629 4.1201342 1.9308486 ] [ 4.2108425 3.3351946 -0.0689476 ] [ 4.0846978 2.4192269 4.826881 ] [ 4.9653632 4.5028742 3.5770471 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2258166e-10 2.108465e-10 3.0584919e-10 ] [ 3.1462629e-10 4.1201342e-10 1.9308486e-10 ] [ 4.2108425e-10 3.3351946e-10 -6.89476e-12 ] [ 4.0846978e-10 2.4192269e-10 4.826881e-10 ] [ 4.9653632e-10 4.5028742e-10 3.5770471e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 3.7e-06 -1.06e-05 ] [ -3.63e-05 -1.61e-05 -4.9e-05 ] [ -7.7e-06 1.93e-05 -2.89e-05 ] [ 5.6e-06 7.9e-06 5.45e-05 ] [ 3.27e-05 -1.48e-05 3.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 5.928053496960001e-15 -1.698307218048e-14 ] [ -5.815901133504e-14 -2.579504359488e-14 -7.85066544192e-14 ] [ -1.233675998016e-14 3.092200878144e-14 -4.630290434112001e-14 ] [ 8.972189076479999e-15 1.265719530432e-14 8.731862583360001e-14 ] [ 5.239117550016001e-14 -2.371221398784e-14 5.44740051072e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }