{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9911471 -4.3945636 -4.0917431 ] [ -1.2759965 -0.7088452 3.1274088 ] [ -0.2697147 2.1462544 -1.120617 ] [ -1.7112902 2.6406758 -0.0073837 ] [ 4.2481485 0.3164787 2.0923351 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.58799271139372e-09 -7.040867058538683e-09 -6.555695133139718e-09 ] [ -2.044371760522627e-09 -1.1356952072063e-09 5.010661263044183e-09 ] [ -4.321305866260857e-10 3.438678621969132e-09 -1.795426358271033e-09 ] [ -2.741789149844156e-09 4.230829029872337e-09 -1.182999151500096e-11 ] [ 6.806284208386589e-09 5.07054774121177e-10 3.35229038009923e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.800686 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.211113646020187e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1232939 1.83222 2.286193 ] [ 1.7511992 2.0790225 4.6693129 ] [ 2.3297698 4.2336377 2.1430256 ] [ 4.4300336 1.3112581 2.7735109 ] [ 3.6952515 3.3118928 3.9081816 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1232939e-10 1.83222e-10 2.286193e-10 ] [ 1.7511992e-10 2.0790225e-10 4.6693129e-10 ] [ 2.3297698e-10 4.2336377e-10 2.1430256e-10 ] [ 4.4300336e-10 1.3112581e-10 2.7735109e-10 ] [ 3.6952515e-10 3.3118928e-10 3.9081816e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.19e-05 1.54e-05 5.5e-06 ] [ -7e-07 -2.1e-06 6.6e-06 ] [ -8.8e-06 3e-06 -3.7e-06 ] [ -5e-06 -7.2e-06 2e-06 ] [ -7.4e-06 -9.2e-06 -1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.508766799552e-14 2.467351996032e-14 8.8119714144e-15 ] [ -1.12152363456e-15 -3.36457090368e-15 1.057436569728e-14 ] [ -1.409915426304e-14 4.8065298624e-15 -5.928053496960001e-15 ] [ -8.010883104e-15 -1.153567166976e-14 3.2043532416e-15 ] [ -1.185610699392e-14 -1.474002491136e-14 -1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.390494 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.465828966936268e-18 } }