{ "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" [ [ -32.1446753 -60.2976838 35.5602906 ] [ -22.7239308 60.5814641 -34.1948893 ] [ -2.1576174 14.5696104 10.46747 ] [ 27.7759709 -12.3196638 -49.3642744 ] [ 29.2502527 -2.5337268 37.5314031 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.150144767317694e-08 -9.660754006868032e-08 5.697386669756984e-08 ] [ -3.640775096039293e-08 9.706220623452982e-08 -5.478625263867661e-08 ] [ -3.456884183391831e-09 2.334308934936339e-08 1.677073585109598e-08 ] [ 4.450201156264395e-08 -1.973827747909565e-08 -7.909028699804436e-08 ] [ 4.686407141453541e-08 -4.059477875899591e-09 6.013193708805516e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.8070513740234517 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.497392121897969e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4246783 1.7701351 2.2681417 ] [ 2.9278754 4.0526079 1.1251159 ] [ 2.6266971 4.056519 3.5637965 ] [ 4.2413765 2.3946873 0.3379991 ] [ 4.6923687 3.3001487 2.6363622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4246783e-10 1.7701351e-10 2.2681417e-10 ] [ 2.9278754e-10 4.0526079e-10 1.1251159e-10 ] [ 2.6266971e-10 4.056519e-10 3.5637965e-10 ] [ 4.241376500000001e-10 2.3946873e-10 3.379991e-11 ] [ 4.6923687e-10 3.3001487e-10 2.6363622e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.8790333 -0.4828929 -0.2590224 ] [ 1.4977714 -0.0075253 -0.093198 ] [ -1.6380138 0.0515248 1.9460277 ] [ -0.4995647 -1.5154139 -2.1225016 ] [ 1.5188404 1.9543073 0.5286944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.408366613767912e-09 -7.736797211044986e-10 -4.149996369626015e-10 ] [ 2.399694340153467e-09 -1.20568598238402e-11 -1.49319657935532e-10 ] [ -2.624387436529549e-09 8.255183063152319e-11 3.117880110056761e-09 ] [ -8.003908895112197e-10 -2.427960741418812e-09 -3.400622469147614e-09 ] [ 2.433450599655213e-09 3.131145491715628e-09 8.470618142066495e-10 ] ] } "relaxed-potential-energy" { "source-value" 1.6568863740234505 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.654624633653357e-19 } }