{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.371302 1.822431 2.77878 ] [ 1.953583 1.464236 4.887458 ] [ 2.036561 3.993513 4.302634 ] [ 4.621904 2.219697 2.273588 ] [ 4.551448 2.283743 4.505208 ] [ 4.054448 4.223119 3.103646 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.371302e-10 1.822431e-10 2.77878e-10 ] [ 1.953583e-10 1.464236e-10 4.887458e-10 ] [ 2.036561e-10 3.993513e-10 4.302634e-10 ] [ 4.621904e-10 2.219697e-10 2.273588e-10 ] [ 4.551448e-10 2.283743e-10 4.505208e-10 ] [ 4.054448e-10 4.223119e-10 3.103646e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.3917819 -4.8203042 -7.2998947 ] [ -0.5805546 -1.3264201 3.8714894 ] [ -2.8003767 3.1392889 1.2327005 ] [ 3.0383659 -3.3510185 -6.0330496 ] [ 5.3166711 -2.9626422 8.7937772 ] [ 1.4176763 9.3210961 -0.5650229 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.02407635254326e-08 -7.722978694384048e-09 -1.169572062264183e-08 ] [ -9.301510072178958e-10 -2.125159273579198e-09 6.20280980435502e-09 ] [ -4.486698078173056e-09 5.029695281516949e-09 1.975003921548471e-09 ] [ 4.867998810415951e-09 -5.368923496568285e-09 -9.666011021246791e-09 ] [ 8.518246136903018e-09 -4.746676068635478e-09 1.408918423836408e-08 ] [ 2.271367823722247e-09 1.493404225165006e-08 -9.052664805966164e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4649777 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.516456598733336e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.058716 1.7291067 2.4785626 ] [ 2.3984078 1.6971881 5.0548505 ] [ 1.8285723 3.9264838 3.8468541 ] [ 4.3980013 2.1628296 2.1754874 ] [ 4.7376916 2.1309249 4.7517851 ] [ 4.167857 4.3602059 3.5437743 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.058716e-10 1.7291067e-10 2.4785626e-10 ] [ 2.3984078e-10 1.6971881e-10 5.0548505e-10 ] [ 1.8285723e-10 3.926483800000001e-10 3.8468541e-10 ] [ 4.3980013e-10 2.1628296e-10 2.1754874e-10 ] [ 4.7376916e-10 2.1309249e-10 4.7517851e-10 ] [ 4.167857e-10 4.360205900000001e-10 3.5437743e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 -1e-05 -2.2e-06 ] [ -4.8e-06 1.92e-05 -7.3e-06 ] [ 2.2e-06 -9.8e-06 8e-06 ] [ 1.1e-06 -6.2e-06 7.2e-06 ] [ -1.8e-06 5e-06 -2.03e-05 ] [ 2.5e-06 1.8e-06 1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 -1.6021766208e-14 -3.52478856576e-15 ] [ -7.69044777984e-15 3.076179111936e-14 -1.169588933184e-14 ] [ 3.52478856576e-15 -1.570133088384e-14 1.28174129664e-14 ] [ 1.76239428288e-15 -9.93349504896e-15 1.153567166976e-14 ] [ -2.88391791744e-15 8.010883104e-15 -3.252418540224e-14 ] [ 4.005441552e-15 2.88391791744e-15 2.339177866368e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.187542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273094809901807e-18 } }