{ "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" [ [ 1.109941 1.98713 2.733868 ] [ 1.585411 0.9055996 0.7031416 ] [ 2.255239 0.4517476 2.903783 ] [ 2.131264 2.335298 0.7662027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.109941e-10 1.98713e-10 2.733868e-10 ] [ 1.585411e-10 9.055996e-11 7.031416000000001e-11 ] [ 2.255239e-10 4.517476000000001e-11 2.903783e-10 ] [ 2.131264e-10 2.335298e-10 7.662027e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.5494284 11.5983593 4.5664004 ] [ -17.0661548 -48.143241 -6.0000882 ] [ 7.8205193 -11.6115672 3.1596949 ] [ 18.7950639 48.1564489 -1.726007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.5299871050536e-08 1.85826202631966e-08 7.316180022368253e-09 ] [ -2.734299445278694e-08 -7.71339758152308e-08 -9.613201115979119e-09 ] [ 1.252985328820604e-08 -1.86037816519608e-08 5.062389339348966e-09 ] [ 3.011301221511691e-08 7.7155137203995e-08 -2.765368085520438e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 9.9119865 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.588075316682344e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4705358 2.4816119 3.0477981 ] [ 2.0703955 0.3582762 0.5057001 ] [ 1.8268563 0.1355094 2.8629042 ] [ 1.7140673 2.7043777 0.6905929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4705358e-10 2.4816119e-10 3.0477981e-10 ] [ 2.0703955e-10 3.582762e-11 5.057001e-11 ] [ 1.8268563e-10 1.355094e-11 2.8629042e-10 ] [ 1.7140673e-10 2.7043777e-10 6.905929e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.1e-06 4.4e-06 2.5e-06 ] [ -1.9e-06 -5.2e-06 -5.3e-06 ] [ 3.2e-06 -4e-07 6e-07 ] [ 2.8e-06 1.2e-06 2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.568924199399999e-15 7.0495771896e-15 4.005441585e-15 ] [ -3.0441356046e-15 -8.331318496799998e-15 -8.4915361602e-15 ] [ 5.1269652288e-15 -6.408706536e-16 9.613059803999998e-16 ] [ 4.486094575199999e-15 1.9226119608e-15 3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6361973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383671352067389e-18 } }