{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.889016 4.339495 1.275975 ] [ 2.554838 3.101562 2.999193 ] [ 4.055705 3.657127 1.332404 ] [ 4.476672 4.505138 3.486766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.889016e-10 4.339495e-10 1.275975e-10 ] [ 2.554838e-10 3.101562e-10 2.999193e-10 ] [ 4.055705e-10 3.657127e-10 1.332404e-10 ] [ 4.476672e-10 4.505138e-10 3.486766e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7837068 5.5623827 -5.9959882 ] [ -2.7557681 -6.3033685 8.8033811 ] [ 8.0396967 -1.4704247 -6.2580965 ] [ 2.4997781 2.2114105 3.4507036 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.247087305812198e-08 8.91191951788238e-09 -9.606632112632676e-09 ] [ -4.415227222166437e-09 -1.009910964298717e-08 1.410457138241259e-08 ] [ 1.288101409106291e-08 -2.355880076986853e-09 -1.002657590301031e-08 ] [ 4.005086029007844e-09 3.543070202091639e-09 5.528636633230396e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7418394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.1994408470683e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9723562 4.9104131 0.9149366 ] [ 2.5010437 2.1611799 3.2243518 ] [ 3.7876521 3.4956651 1.6668156 ] [ 4.7151791 5.0360639 3.288234 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9723562e-10 4.9104131e-10 9.149366e-11 ] [ 2.5010437e-10 2.1611799e-10 3.2243518e-10 ] [ 3.7876521e-10 3.4956651e-10 1.6668156e-10 ] [ 4.7151791e-10 5.0360639e-10 3.288234e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.47e-05 1.3e-06 6.6e-06 ] [ 3.23e-05 1.49e-05 6e-07 ] [ -3.11e-05 1.4e-05 1.56e-05 ] [ -3.59e-05 -3.01e-05 -2.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.559552874176001e-14 2.08282960704e-15 1.057436569728e-14 ] [ 5.175030485184e-14 2.387243164992e-14 9.6130597248e-16 ] [ -4.982769290688e-14 2.24304726912e-14 2.499395528448e-14 ] [ -5.751814068672e-14 -4.822551628608e-14 -3.668984461632e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.1265651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.462236923142922e-18 } }