{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3823155 -2.6964789 -0.4881471 ] [ -0.1321675 1.7904465 -1.3670282 ] [ 4.1643923 -1.3226636 -0.6287486 ] [ -1.0458168 2.4471857 -0.2897401 ] [ -0.6040924 -0.2184896 2.773664 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.816890228916027e-09 -4.320235487654022e-09 -7.820978775748613e-10 ] [ -2.11755680274195e-10 2.868611546727081e-09 -2.190220640059079e-09 ] [ 6.672092037869518e-09 -2.119140714562322e-09 -1.007366315580212e-09 ] [ -1.675583240404651e-09 3.920823747598933e-09 -4.642148181528233e-10 ] [ -9.678627280569815e-10 -3.500589318920064e-10 4.443899651366976e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.288596 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.808632474186586e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.951432 2.1598056 1.7278082 ] [ 4.7424563 1.2270654 3.152364 ] [ 5.3398818 3.1566309 1.7286405 ] [ 3.3349005 4.6008665 1.6916658 ] [ 3.8247214 3.4254606 3.8095944 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.951432e-10 2.1598056e-10 1.7278082e-10 ] [ 4.7424563e-10 1.2270654e-10 3.152364e-10 ] [ 5.3398818e-10 3.1566309e-10 1.7286405e-10 ] [ 3.3349005e-10 4.600866500000001e-10 1.6916658e-10 ] [ 3.8247214e-10 3.4254606e-10 3.8095944e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.2e-06 3.6e-06 1e-06 ] [ -1.6e-06 -1.4e-06 -2e-07 ] [ -4.1e-06 2.7e-06 -2.2e-06 ] [ 1e-06 -1.9e-06 -6.6e-06 ] [ 6e-07 -3e-06 8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.729141862799999e-15 5.767835882399999e-15 1.602176634e-15 ] [ -2.5634826144e-15 -2.2430472876e-15 -3.204353268e-16 ] [ -6.568924199399999e-15 4.3258769118e-15 -3.5247885948e-15 ] [ 1.602176634e-15 -3.0441356046e-15 -1.05743657844e-14 ] [ 9.613059803999998e-16 -4.806529901999999e-15 1.2817413072e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.399219 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.146791559564885e-18 } }