{ "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" [ [ 0.8164278 0.1663691 0.8726527 ] [ 0.2293415 1.783801 2.502887 ] [ 2.371717 0.4239938 0.3261347 ] [ 1.905698 2.704881 0.8462502 ] [ 2.020767 2.181943 2.752956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.164278e-11 1.663691e-11 8.726527e-11 ] [ 2.293415e-11 1.783801e-10 2.502887e-10 ] [ 2.371717e-10 4.239938e-11 3.261347e-11 ] [ 1.905698e-10 2.704881e-10 8.462502e-11 ] [ 2.020767e-10 2.181943e-10 2.752956e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -711.0941494 -46.5488612 336.8018465 ] [ -158.2128302 -185.7582832 -132.4585665 ] [ 587.8093755 302.8218628 -184.6958681 ] [ 87.9106982 -119.7431769 -136.1068281 ] [ 193.5869059 49.2284584 116.4594162 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.139298430742785e-06 -7.457949775394919e-08 5.396160487503546e-07 ] [ -2.534848997454496e-07 -2.976175809149947e-07 -2.122220202194351e-07 ] [ 9.417744466722319e-07 4.851741128425137e-07 -2.959154042661659e-07 ] [ 1.408484665346658e-07 -1.918497201101085e-07 -2.180671797096746e-07 ] [ 3.101604172813367e-07 7.887268577632103e-08 1.865885554449211e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 212.37889 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.402684951128563e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.1830244 -0.4930371 0.9172614 ] [ -0.2436865 1.2171525 3.115349 ] [ 2.4069132 0.4785918 -0.5139469 ] [ 3.1856604 2.9148673 0.6667762 ] [ 1.8120398 3.1434134 3.1154409 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.830244e-11 -4.930371e-11 9.172614e-11 ] [ -2.436865e-11 1.2171525e-10 3.115349e-10 ] [ 2.4069132e-10 4.785918e-11 -5.139469e-11 ] [ 3.1856604e-10 2.9148673e-10 6.667762e-11 ] [ 1.8120398e-10 3.1434134e-10 3.1154409e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 -5e-07 -3e-07 ] [ 6e-07 1.3e-06 8e-07 ] [ 6e-07 4e-07 -3e-07 ] [ -9e-07 -2e-07 1.3e-06 ] [ -1e-07 -1e-06 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.204353268e-16 -8.010883169999999e-16 -4.806529901999999e-16 ] [ 9.613059803999998e-16 2.0828296242e-15 1.2817413072e-15 ] [ 9.613059803999998e-16 6.408706536e-16 -4.806529901999999e-16 ] [ -1.4419589706e-15 -3.204353268e-16 2.0828296242e-15 ] [ -1.602176634e-16 -1.602176634e-15 -2.403264951e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.190057 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.953062449252814e-18 } }