{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0441772 3.0289867 1.9976087 ] [ -8.1133788 14.5627843 4.1760909 ] [ -19.5918483 -9.4274605 -8.8725067 ] [ 7.221514 -10.4394205 -1.0531965 ] [ 1.5324277 -1.6349611 1.3525972 ] [ 21.2277998 5.5410585 0.0814357 ] [ -3.3206915 -1.6309873 2.3179708 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.672956297812406e-09 4.852971675454144e-09 3.200521956646681e-09 ] [ -1.299906582905436e-08 2.33321525392133e-08 6.690835206315631e-09 ] [ -3.138960130452022e-08 -1.510445680661548e-08 -1.421532280263136e-08 ] [ 1.157014089757989e-08 -1.672579545980025e-08 -1.687406809408387e-09 ] [ 2.455219834006316e-09 -2.619496450337451e-09 2.167099611199542e-09 ] [ 3.401068455058291e-08 8.877754383185117e-09 1.304743746384826e-10 ] [ -5.320334286189283e-09 -2.613129720881716e-09 3.713798623457073e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.695842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.354533447537072e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2822709 1.717836 3.2392966 ] [ 2.8790742 5.995794 2.6165025 ] [ 2.5365035 3.6345604 1.3953202 ] [ 4.5730085 1.8604096 1.9458323 ] [ 5.7375059 3.0078696 4.0117694 ] [ 5.0540926 4.5745407 1.9581797 ] [ 3.3108474 3.9144808 4.1610722 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2822709e-10 1.717836e-10 3.2392966e-10 ] [ 2.8790742e-10 5.995794e-10 2.6165025e-10 ] [ 2.5365035e-10 3.6345604e-10 1.3953202e-10 ] [ 4.5730085e-10 1.8604096e-10 1.9458323e-10 ] [ 5.737505900000001e-10 3.0078696e-10 4.011769400000001e-10 ] [ 5.0540926e-10 4.5745407e-10 1.9581797e-10 ] [ 3.3108474e-10 3.914480800000001e-10 4.1610722e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 -5.16e-05 -6.7e-06 ] [ 4e-06 -2.64e-05 -1.52e-05 ] [ -5.62e-05 5.33e-05 -7e-07 ] [ -3.3e-06 -2.27e-05 2.71e-05 ] [ 1.26e-05 4.1e-06 -2.5e-06 ] [ 4.75e-05 2.63e-05 4.3e-06 ] [ -4.9e-06 1.71e-05 -6.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-16 -8.267231363328e-14 -1.073458335936e-14 ] [ 6.4087064832e-15 -4.229746278912e-14 -2.435308463616e-14 ] [ -9.004232608896e-14 8.539601388864e-14 -1.12152363456e-15 ] [ -5.28718284864e-15 -3.636940929216e-14 4.341898642368e-14 ] [ 2.018742542208e-14 6.568924145279999e-15 -4.005441552e-15 ] [ 7.610338948800001e-14 4.213724512704e-14 6.889359469440001e-15 ] [ -7.850665441919999e-15 2.739722021568e-14 -1.009371271104e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.721356 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.800580199687381e-18 } }