{ "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" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4115762 -0.3646439 4.1602418 ] [ -1.4448519 -1.3045565 1.4211237 ] [ -6.3695618 0.9268918 -4.6857955 ] [ -3.0727241 4.3753389 2.4389854 ] [ 7.8937574 -0.5482616 -6.456924 ] [ 2.5818041 -3.0847686 3.1223686 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.594177653177049e-10 -5.842239314973332e-10 6.665442148834909e-09 ] [ -2.314907934698459e-09 -2.090129924812675e-09 2.276891167404793e-09 ] [ -1.020516300070077e-08 1.485044371971229e-09 -7.507471999949847e-09 ] [ -4.923046715188721e-09 7.010065693656789e-09 3.907685386352536e-09 ] [ 1.2647193556547e-08 -8.784119176024013e-10 -1.034513267508242e-08 ] [ 4.136506168505585e-09 -4.942344131497947e-09 5.002585972440028e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.938357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.713823958016403e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0703607 1.484525 3.0419408 ] [ 1.6114609 2.7002595 5.200565 ] [ 1.1409039 3.1845661 1.4312918 ] [ 2.2693333 4.3137206 3.3806266 ] [ 3.6944892 2.9648236 1.7667927 ] [ 3.99993 2.6504402 4.213459 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0703607e-10 1.484525e-10 3.0419408e-10 ] [ 1.6114609e-10 2.7002595e-10 5.200565e-10 ] [ 1.1409039e-10 3.1845661e-10 1.4312918e-10 ] [ 2.2693333e-10 4.3137206e-10 3.3806266e-10 ] [ 3.6944892e-10 2.9648236e-10 1.7667927e-10 ] [ 3.99993e-10 2.6504402e-10 4.213459e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.23e-05 4.04e-05 3.33e-05 ] [ 3.1e-05 -2.34e-05 -4.91e-05 ] [ 2.06e-05 2.41e-05 9e-06 ] [ 9.2e-06 -4.24e-05 -8.8e-06 ] [ -3.86e-05 -2.45e-05 2.76e-05 ] [ -4.45e-05 2.57e-05 -1.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.572853864384e-14 6.472793548032e-14 5.335248147264001e-14 ] [ 4.96674752448e-14 -3.749093292672001e-14 -7.866687208128001e-14 ] [ 3.300483838848e-14 3.861245656128e-14 1.44195895872e-14 ] [ 1.474002491136e-14 -6.793228872192001e-14 -1.409915426304e-14 ] [ -6.184401756288e-14 -3.92533272096e-14 4.422007473408001e-14 ] [ -7.129685962560001e-14 4.117593915456e-14 -1.938633711168e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.62566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.304595024056973e-18 } }