{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -45.6257043 -17.4181042 -29.3957005 ] [ -15.438219 45.7340573 36.6066085 ] [ -15.5847255 -15.2647606 -2.9391273 ] [ 26.4397555 4.5248813 -8.5774268 ] [ 49.839084 -46.7525609 18.341449 ] [ 15.3694155 -18.9624061 -52.8486168 ] [ -14.9996062 48.1388932 38.8128139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.310043673699404e-08 -2.790687932789829e-08 -4.709710409313888e-08 ] [ -2.473475354859035e-08 7.327403738038758e-08 5.865025230547856e-08 ] [ -2.496948283768559e-08 -2.445684255542898e-08 -4.709001045615028e-09 ] [ 4.236115812176821e-08 7.24965903075511e-09 -1.374255268558336e-08 ] [ 7.985101518688734e-08 -7.49058600365082e-08 2.938624077939554e-08 ] [ 2.462451818946114e-08 -3.03811237275353e-08 -8.467281827857812e-08 ] [ -2.403201837484673e-08 7.712700923622811e-08 6.218498301804127e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 26.827984 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.298316874799647e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5959686 1.1818009 2.543645 ] [ 1.9982104 2.9210861 4.751853 ] [ 1.364317 3.9499315 1.9547126 ] [ 4.2323337 1.1917718 1.9498371 ] [ 4.7488146 2.3522801 4.3351228 ] [ 3.9560904 3.6389385 0.8371057 ] [ 3.8854703 4.885896 3.3872389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5959686e-10 1.1818009e-10 2.543645e-10 ] [ 1.9982104e-10 2.9210861e-10 4.751852999999999e-10 ] [ 1.364317e-10 3.9499315e-10 1.9547126e-10 ] [ 4.2323337e-10 1.1917718e-10 1.9498371e-10 ] [ 4.7488146e-10 2.352280100000001e-10 4.3351228e-10 ] [ 3.9560904e-10 3.6389385e-10 8.371057e-11 ] [ 3.8854703e-10 4.885896e-10 3.3872389e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 -1.55e-05 4.5e-06 ] [ -3.4e-06 1.63e-05 -4.21e-05 ] [ 8.3e-06 3.17e-05 1.06e-05 ] [ -6.7e-06 -2.43e-05 3.19e-05 ] [ 5.74e-05 -1.53e-05 -2.2e-06 ] [ 1e-06 2.43e-05 -3.8e-06 ] [ -4.91e-05 -1.72e-05 1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.217654231808e-14 -2.48337376224e-14 7.2097947936e-15 ] [ -5.44740051072e-15 2.611547891904e-14 -6.745163573568001e-14 ] [ 1.329806595264e-14 5.078899887936e-14 1.698307218048e-14 ] [ -1.073458335936e-14 -3.893289188544e-14 5.110943420352001e-14 ] [ 9.196493803392e-14 -2.451330229824e-14 -3.52478856576e-15 ] [ 1.6021766208e-15 3.893289188544e-14 -6.08827115904e-15 ] [ -7.866687208128001e-14 -2.755743787776e-14 1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.651734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148554877298047e-18 } }