{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3686723 0.302611 0.1656961 ] [ -3.1692087 3.5786648 -0.217903 ] [ -0.0020046 -0.7691334 -0.3939782 ] [ 1.5175528 -2.6053989 -0.4952467 ] [ 1.2849883 -0.5067436 0.9414318 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.906781397965639e-10 4.848362693969088e-10 2.654744175777389e-10 ] [ -5.077632085575961e-09 5.733653076239907e-09 -3.491190922021824e-10 ] [ -3.21172325405568e-12 -1.232287551756415e-09 -6.312226611448666e-10 ] [ 2.431387616989579e-09 -4.174309205438037e-09 -7.934726842683513e-10 ] [ 2.058778212261537e-09 -8.118927486600268e-10 1.508340020037661e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.11031939923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.585457645474938e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2209616 1.9719421 2.0025475 ] [ 2.4584632 4.0307353 1.0049969 ] [ 2.8958008 3.8183466 3.3223428 ] [ 4.2085901 2.448211 0.8071516 ] [ 5.1291803 3.304863 2.7943766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2209616e-10 1.9719421e-10 2.0025475e-10 ] [ 2.4584632e-10 4.0307353e-10 1.0049969e-10 ] [ 2.8958008e-10 3.8183466e-10 3.3223428e-10 ] [ 4.208590100000001e-10 2.448211e-10 8.071516e-11 ] [ 5.1291803e-10 3.304863e-10 2.7943766e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.7e-06 1.99e-05 -3e-07 ] [ 5e-06 -7.3e-06 -1e-07 ] [ -1.09e-05 -9.5e-06 9.6e-06 ] [ -5e-07 -6.9e-06 -1.2e-06 ] [ -3e-07 3.9e-06 -8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.073458335936e-14 3.188331475392e-14 -4.8065298624e-16 ] [ 8.010883104e-15 -1.169588933184e-14 -1.6021766208e-16 ] [ -1.746372516672e-14 -1.52206778976e-14 1.538089555968e-14 ] [ -8.010883104e-16 -1.105501868352e-14 -1.92261194496e-15 ] [ -4.8065298624e-16 6.24848882112e-15 -1.28174129664e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.092110399234951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.158460232186793e-19 } }