{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1831465 2.116708 2.654984 ] [ 2.667227 1.663235 3.267218 ] [ 1.69792 3.784061 1.911913 ] [ 4.015612 2.751902 1.554252 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.831465e-11 2.116708e-10 2.654984e-10 ] [ 2.667227e-10 1.663235e-10 3.267218e-10 ] [ 1.69792e-10 3.784061e-10 1.911913e-10 ] [ 4.015612e-10 2.751902e-10 1.554252e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1406031 -1.4097253 0.3713163 ] [ -0.6433745 -0.233118 0.8696778 ] [ 1.2403298 1.2995316 -0.294154 ] [ 0.5436478 0.3433117 -0.9468402 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.827447635487965e-09 -2.25862893601864e-09 5.949142996833342e-10 ] [ -1.030799590811433e-09 -3.73496212564812e-10 1.393377450268525e-09 ] [ 1.987227424013893e-09 2.082079164664634e-09 -4.71286665597636e-10 ] [ 8.710198022855051e-10 5.500459839188177e-10 -1.517005244571887e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6582818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.226992015654746e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1588038 2.0296001 1.8455034 ] [ 2.8297101 2.1391855 4.3002029 ] [ 2.0053792 3.4721987 2.4547559 ] [ 3.5700124 2.6749217 0.7879049 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.588038e-11 2.0296001e-10 1.8455034e-10 ] [ 2.8297101e-10 2.1391855e-10 4.3002029e-10 ] [ 2.0053792e-10 3.4721987e-10 2.4547559e-10 ] [ 3.5700124e-10 2.6749217e-10 7.879049e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 2e-07 -0.0 ] [ -2e-07 6e-07 2e-07 ] [ 5e-07 -1.3e-06 4e-07 ] [ 3e-07 5e-07 -5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883169999999e-16 3.204353268e-16 0.0 ] [ -3.204353268e-16 9.613059803999998e-16 3.204353268e-16 ] [ 8.010883169999999e-16 -2.0828296242e-15 6.408706536e-16 ] [ 4.806529901999999e-16 8.010883169999999e-16 -8.010883169999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -9.1265651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.462236935189987e-18 } }