{ "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" [ [ 0.223645 0.1945873 1.126976 ] [ 0.7288277 2.388611 0.0814776 ] [ 2.404153 0.5300895 0.5572584 ] [ 2.145602 0.6403931 2.690423 ] [ 2.26761 2.998114 1.480003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.23645e-11 1.945873e-11 1.126976e-10 ] [ 7.288277e-11 2.388611e-10 8.14776e-12 ] [ 2.404153e-10 5.300895e-11 5.572584000000001e-11 ] [ 2.145602e-10 6.403931000000001e-11 2.690423e-10 ] [ 2.26761e-10 2.998114e-10 1.480003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.8018302 -3.4920073 -2.0396817 ] [ -6.7579958 0.3906811 -6.8253136 ] [ 5.7052493 -3.635775 -9.9229614 ] [ 3.6736212 -0.1080928 12.9184136 ] [ 6.1809555 6.845194 5.8695432 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.410208668287554e-08 -5.594812501817428e-09 -3.267930360537398e-09 ] [ -1.082750296343013e-08 6.259401297654173e-10 -1.093535796964242e-08 ] [ 9.140817119604857e-09 -5.82515375148135e-09 -1.589833689516393e-08 ] [ 5.88579004880704e-09 -1.731837584636352e-10 2.069758041826782e-08 ] [ 9.902982477893786e-09 1.0967209881997e-08 9.404044967293587e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3964359 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.024822013985876e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2072985 0.2626747 -0.0989656 ] [ 0.1270378 2.7510512 0.3793214 ] [ 2.1493128 -0.7223458 1.1993275 ] [ 3.2677926 1.1568029 2.4819209 ] [ 2.018396 3.3036118 1.9745337 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072985e-11 2.626747e-11 -9.89656e-12 ] [ 1.270378e-11 2.7510512e-10 3.793214e-11 ] [ 2.1493128e-10 -7.223458000000001e-11 1.1993275e-10 ] [ 3.2677926e-10 1.1568029e-10 2.4819209e-10 ] [ 2.018396e-10 3.3036118e-10 1.9745337e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.77e-05 -6e-07 1.93e-05 ] [ 1.57e-05 1.7e-05 2.08e-05 ] [ -3.7e-06 -2.16e-05 3.7e-06 ] [ -2.89e-05 -9.8e-06 -3.3e-05 ] [ -2.07e-05 1.5e-05 -1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.040205910179999e-14 -9.613059803999998e-16 3.09220090362e-14 ] [ 2.515417315379999e-14 2.723700277799999e-14 3.332527398719999e-14 ] [ -5.9280535458e-15 -3.46070152944e-14 5.9280535458e-15 ] [ -4.63029047226e-14 -1.57013310132e-14 -5.287182892199999e-14 ] [ -3.316505632379999e-14 2.403264951e-14 -1.73035076472e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.716098 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.197561172525413e-18 } }