{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6799312 1.3591668 0.5752258 ] [ -0.2575219 -0.0338679 0.5042349 ] [ 0.0588895 -1.111964 0.2663429 ] [ -0.7700107 0.7266183 -0.3071839 ] [ 1.1015595 -0.1516426 -1.1279458 ] [ 1.4798082 0.4167229 -0.3651963 ] [ 0.0672066 -1.2050334 0.4545224 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.691546493192489e-09 2.177625270727549e-09 9.216133284409766e-10 ] [ -4.125955675239955e-10 -5.426235757559232e-11 8.07873368171426e-10 ] [ 9.43513801106016e-11 -1.781562723971251e-09 4.267283674960723e-10 ] [ -1.233693141305843e-09 1.164170852505441e-09 -4.921628628661651e-10 ] [ 1.764892877320138e-09 -2.42958228437326e-10 -1.807168390289553e-09 ] [ 2.37091410130813e-09 6.676636877319763e-10 -5.85108973862663e-10 ] [ 1.076768432834573e-10 -1.930676340763135e-09 7.282251629099059e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.1223 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.223947861672384e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8544464 5.0499898 2.6594209 ] [ 4.9568143 2.6857575 1.4230881 ] [ 2.7924381 2.6700327 2.4176966 ] [ 5.8603308 3.0710165 3.5931653 ] [ 4.739462 5.0458842 1.1852564 ] [ 5.1221037 5.346381 3.5282807 ] [ 3.6829446 3.5902484 4.4392471 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8544464e-10 5.0499898e-10 2.6594209e-10 ] [ 4.956814299999999e-10 2.6857575e-10 1.4230881e-10 ] [ 2.7924381e-10 2.6700327e-10 2.4176966e-10 ] [ 5.8603308e-10 3.0710165e-10 3.5931653e-10 ] [ 4.739461999999999e-10 5.0458842e-10 1.1852564e-10 ] [ 5.1221037e-10 5.346381e-10 3.5282807e-10 ] [ 3.6829446e-10 3.5902484e-10 4.4392471e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.9e-06 -1.7e-06 2.5e-06 ] [ -1.59e-05 1.9e-06 6e-06 ] [ 3.4e-06 -4e-06 -8.5e-06 ] [ 1.1e-05 -2e-07 1.15e-05 ] [ 7.2e-06 1.17e-05 -6.5e-06 ] [ -1.3e-06 -1e-05 -8.1e-06 ] [ 1.4e-06 2.2e-06 3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.45284206272e-15 -2.72370025536e-15 4.005441552e-15 ] [ -2.547460827072e-14 3.04413557952e-15 9.6130597248e-15 ] [ 5.44740051072e-15 -6.4087064832e-15 -1.36185012768e-14 ] [ 1.76239428288e-14 -3.2043532416e-16 1.84250311392e-14 ] [ 1.153567166976e-14 1.874546646336e-14 -1.04141480352e-14 ] [ -2.08282960704e-15 -1.6021766208e-14 -1.297763062848e-14 ] [ 2.24304726912e-15 3.52478856576e-15 4.8065298624e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319314854257e-18 } }