{ "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" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8209401 -1.8216816 -3.0590338 ] [ 0.4284582 -0.064874 -1.5746694 ] [ -2.4301248 -0.9838628 1.3129908 ] [ -0.5070664 0.4312993 -0.0358701 ] [ 3.6292619 -1.4705629 1.3827993 ] [ 0.6922054 2.0586044 0.0600548 ] [ 0.0082058 1.8510775 1.9137284 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.917467656097214e-09 -2.918655670061537e-09 -4.901112436596983e-09 ] [ 6.864657110300506e-10 -1.039396060977792e-10 -2.522898498169164e-09 ] [ -3.893489140186276e-09 -1.576321976234826e-09 2.103643163085488e-09 ] [ -8.124099312732212e-10 6.910176550274055e-10 -5.747023560575808e-11 ] [ 5.814718566940187e-09 -2.356101497795848e-09 2.215488709718606e-09 ] [ 1.109035308671512e-09 3.298247841156012e-09 9.621839652681985e-11 ] [ 1.314714091496064e-11 2.965753093788912e-09 3.066130901040991e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.155773 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.069093165395188e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2731869 1.7544537 1.5932738 ] [ 1.3876926 3.0095358 4.6229106 ] [ 1.975117 0.856136 3.7911523 ] [ 1.1633897 3.7297027 2.3634695 ] [ 4.1426998 1.6561063 3.1681541 ] [ 3.5427033 3.7801377 2.1128949 ] [ 3.6926358 3.5966387 4.4941328 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2731869e-10 1.7544537e-10 1.5932738e-10 ] [ 1.3876926e-10 3.0095358e-10 4.6229106e-10 ] [ 1.975117e-10 8.56136e-11 3.7911523e-10 ] [ 1.1633897e-10 3.7297027e-10 2.3634695e-10 ] [ 4.1426998e-10 1.6561063e-10 3.1681541e-10 ] [ 3.5427033e-10 3.7801377e-10 2.1128949e-10 ] [ 3.692635800000001e-10 3.596638700000001e-10 4.4941328e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 -2.5e-06 -3.4e-06 ] [ 7.73e-05 -1.5e-05 -4.72e-05 ] [ -1e-07 2.79e-05 -2.52e-05 ] [ 5.6e-06 -1.38e-05 3.53e-05 ] [ -4.45e-05 7e-06 1.39e-05 ] [ -1.2e-05 -3.1e-05 -5.7e-06 ] [ -3.01e-05 2.73e-05 3.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.08827115904e-15 -4.005441552e-15 -5.44740051072e-15 ] [ 1.2384825278784e-13 -2.4032649312e-14 -7.562273650176e-14 ] [ -1.6021766208e-16 4.470072772032e-14 -4.037485084416e-14 ] [ 8.972189076479999e-15 -2.211003736704e-14 5.655683471424e-14 ] [ -7.129685962560001e-14 1.12152363456e-14 2.227025502912e-14 ] [ -1.92261194496e-14 -4.96674752448e-14 -9.13240673856e-15 ] [ -4.822551628608e-14 4.373942174784e-14 5.175030485184e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319314854257e-18 } }