{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -50.9530767 16.6794277 -49.015743 ] [ 4.0403925 -12.8112147 52.7545157 ] [ 23.7557542 -15.266853 -13.7452759 ] [ -34.6079103 41.969992 -39.2802611 ] [ 57.7648403 -30.571352 49.2867643 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.163582891914981e-08 2.672338932943236e-08 -7.853187813274905e-08 ] [ 6.473422455688845e-09 -2.052582884549732e-08 8.452205239252614e-08 ] [ 3.806091430228735e-08 -2.44601951513128e-08 -2.202235987486332e-08 ] [ -5.544798523422792e-08 6.724334051156692e-08 -6.293391651183913e-08 ] [ 9.254947739540154e-08 -4.898070584418916e-08 7.896610212692537e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 33.741285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.405949842813468e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0343872 0.9776423 0.9023928 ] [ 0.3786325 0.4149287 3.252205 ] [ 1.995187 -0.3004005 0.3961502 ] [ 1.445614 2.8989449 1.258823 ] [ 2.5806638 1.031369 2.3690806 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.43872e-12 9.776423e-11 9.023928e-11 ] [ 3.786325e-11 4.149287e-11 3.252205e-10 ] [ 1.995187e-10 -3.004005e-11 3.961502e-11 ] [ 1.445614e-10 2.8989449e-10 1.258823e-10 ] [ 2.5806638e-10 1.031369e-10 2.3690806e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.58e-05 -4.9e-06 -1.28e-05 ] [ 4e-07 3.19e-05 -1.8e-06 ] [ 1.02e-05 -1.19e-05 -1.65e-05 ] [ -1.37e-05 -1.07e-05 2.5e-05 ] [ 1.89e-05 -4.5e-06 6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.53143908172e-14 -7.850665506599998e-15 -2.05078609152e-14 ] [ 6.408706536e-16 5.11094346246e-14 -2.8839179412e-15 ] [ 1.63422016668e-14 -1.90659019446e-14 -2.6435914461e-14 ] [ -2.19498198858e-14 -1.71432899838e-14 4.005441585e-14 ] [ 3.02811383826e-14 -7.209794853e-15 9.773277467399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.950872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.754523124032485e-18 } }