{ "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" [ [ 1.84187 2.347102 1.383115 ] [ 2.042679 1.03426 3.627522 ] [ 0.9834518 3.478775 3.226301 ] [ 4.103178 1.51668 2.106844 ] [ 3.482715 3.397853 2.716774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84187e-10 2.347102e-10 1.383115e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ 9.834518e-11 3.478775e-10 3.226301e-10 ] [ 4.103178e-10 1.51668e-10 2.106844e-10 ] [ 3.482715e-10 3.397853e-10 2.716774e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.2000957 -0.6321159 -18.2762773 ] [ -5.8993545 -16.2823027 12.217921 ] [ -9.3665876 6.6725538 5.0431902 ] [ 12.6557485 -9.042469 -2.2301738 ] [ 14.8102893 19.2843337 3.2453399 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.954670810206261e-08 -1.012761316615951e-09 -2.928182420531775e-08 ] [ -9.451807857711274e-09 -2.608712471872871e-08 1.957526738098136e-08 ] [ -1.500692766939518e-08 1.06906096993902e-08 8.080081432687676e-09 ] [ 2.027674436542467e-08 -1.448763242610876e-08 -3.573132322680696e-09 ] [ 2.37286992637444e-08 3.089690860184556e-08 5.199607714329409e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.7225116 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.566297676976801e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6274553 2.2716814 0.8385651 ] [ 2.1192795 0.9584912 3.9573459 ] [ 1.2010284 3.2618367 3.1973682 ] [ 3.7805385 1.4480265 2.0268606 ] [ 3.7255921 3.8346343 3.0404162 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6274553e-10 2.2716814e-10 8.385651e-11 ] [ 2.1192795e-10 9.584912e-11 3.9573459e-10 ] [ 1.2010284e-10 3.2618367e-10 3.1973682e-10 ] [ 3.7805385e-10 1.4480265e-10 2.0268606e-10 ] [ 3.7255921e-10 3.8346343e-10 3.0404162e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.2e-06 -4.3e-06 -1.99e-05 ] [ 1.34e-05 -1.71e-05 2.04e-05 ] [ -4.1e-05 2.33e-05 -1.6e-06 ] [ 7.1e-06 -3.1e-06 -1.15e-05 ] [ 2.66e-05 1.3e-06 1.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.93349504896e-15 -6.889359469440001e-15 -3.188331475392e-14 ] [ 2.146916671872e-14 -2.739722021568e-14 3.268440306432e-14 ] [ -6.56892414528e-14 3.733071526464e-14 -2.56348259328e-15 ] [ 1.137545400768e-14 -4.96674752448e-15 -1.84250311392e-14 ] [ 4.261789811328e-14 2.08282960704e-15 2.018742542208e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.8977283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.425573226049053e-18 } }