{ "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" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6863685 -5.9664339 -12.2269246 ] [ 8.4680334 -6.713269 2.5053816 ] [ -7.3621843 -6.9165904 13.6559266 ] [ -4.8201437 9.466196 2.1630281 ] [ 10.400663 10.1300973 -6.0974118 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.071274328875357e-08 -9.559280904128566e-09 -1.958969273840439e-08 ] [ 1.356728513763353e-08 -1.07558426409414e-08 4.014063825702498e-09 ] [ -1.179551956348081e-08 -1.108159943452972e-08 2.187920633388083e-08 ] [ -7.722721545036409e-09 1.516651791911048e-08 3.465553051953445e-09 ] [ 1.666369909941959e-08 1.62302050604892e-08 -9.769130633350045e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.6999653 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.530174522231258e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7358331 1.9202973 0.6389231 ] [ 2.7415796 1.4761961 2.1615862 ] [ 1.0844928 2.207962 3.966382 ] [ 0.4998665 3.9448188 2.1830569 ] [ 3.0418398 4.0032668 1.9116308 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.358331e-11 1.9202973e-10 6.389231e-11 ] [ 2.7415796e-10 1.4761961e-10 2.1615862e-10 ] [ 1.0844928e-10 2.207962e-10 3.966382e-10 ] [ 4.998665e-11 3.9448188e-10 2.1830569e-10 ] [ 3.0418398e-10 4.003266799999999e-10 1.9116308e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-06 -5.7e-06 3.02e-05 ] [ -1.9e-05 1.35e-05 -9.9e-06 ] [ 1.76e-05 1.76e-05 -4.58e-05 ] [ 8.9e-06 -9.6e-06 -3e-07 ] [ -1.55e-05 -1.58e-05 2.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-14 -9.13240673856e-15 4.838573394816e-14 ] [ -3.04413557952e-14 2.16293843808e-14 -1.586154854592e-14 ] [ 2.819830852608e-14 2.819830852608e-14 -7.337968923264e-14 ] [ 1.425937192512e-14 -1.538089555968e-14 -4.8065298624e-16 ] [ -2.48337376224e-14 -2.531439060864e-14 4.117593915456e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }