{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.5423429 -21.059264 -8.8303902 ] [ -6.0816702 -9.1452765 -21.4859882 ] [ -53.8826986 47.0886776 16.5947656 ] [ 87.8322563 -67.8156789 28.6109028 ] [ 2.1576027 0.4217128 -3.403054 ] [ -17.4831473 50.5098289 -11.486236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.00950487299958e-08 -3.374066071003737e-08 -1.414784484754259e-08 ] [ -9.743909890134105e-09 -1.46523483197693e-08 -3.442434825243972e-08 ] [ -8.63296006737845e-08 7.544437897667918e-08 2.658774569102699e-08 ] [ 1.407227887553593e-07 -1.086526961524268e-07 4.583971994380517e-08 ] [ 3.456860631395312e-09 6.756583944187151e-10 -5.452293603040235e-09 ] [ -2.801109009284018e-08 8.092566765091792e-08 -1.840297893180962e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 32.633022 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.228386534520794e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8944681 0.4522643 1.4996955 ] [ 0.6667699 2.6066966 0.4887111 ] [ 0.162368 2.319827 2.7236079 ] [ 2.7784578 1.0400299 2.7751663 ] [ 2.7665802 1.5794715 0.5300943 ] [ 2.2481251 3.2460972 2.1638231 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.944681e-11 4.522643e-11 1.4996955e-10 ] [ 6.667699e-11 2.6066966e-10 4.887111e-11 ] [ 1.62368e-11 2.319827e-10 2.7236079e-10 ] [ 2.7784578e-10 1.0400299e-10 2.7751663e-10 ] [ 2.7665802e-10 1.5794715e-10 5.300943000000001e-11 ] [ 2.2481251e-10 3.2460972e-10 2.1638231e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 1.61e-05 -2.5e-05 ] [ -8.1e-06 8.3e-06 2e-07 ] [ -5.12e-05 1.23e-05 1e-05 ] [ 5.93e-05 -1.4e-06 2.9e-06 ] [ -4e-07 -2.88e-05 1.53e-05 ] [ 9e-07 -6.4e-06 -3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883169999999e-16 2.579504380739999e-14 -4.005441585e-14 ] [ -1.29776307354e-14 1.32980660622e-14 3.204353268e-16 ] [ -8.20314436608e-14 1.97067725982e-14 1.602176634e-14 ] [ 9.500907439619998e-14 -2.2430472876e-15 4.6463122386e-15 ] [ -6.408706536e-16 -4.614268705919999e-14 2.45133025002e-14 ] [ 1.4419589706e-15 -1.02539304576e-14 -5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -26.223076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.201399963880618e-18 } }