{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.512586 2.352376 3.000619 ] [ 5.747731 2.138199 1.702882 ] [ 4.441387 1.564453 3.266826 ] [ 5.259627 4.180433 2.034508 ] [ 3.39507 3.451757 1.390248 ] [ 4.402652 3.245897 4.59308 ] [ 3.137856 4.41534 3.36482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.512586e-10 2.352376e-10 3.000619e-10 ] [ 5.747731e-10 2.138199e-10 1.702882e-10 ] [ 4.441387e-10 1.564453e-10 3.266826e-10 ] [ 5.259627e-10 4.180433e-10 2.034508e-10 ] [ 3.39507e-10 3.451757e-10 1.390248e-10 ] [ 4.402652e-10 3.245897e-10 4.59308e-10 ] [ 3.137856000000001e-10 4.41534e-10 3.36482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3250157 -5.0427153 0.0875982 ] [ 3.0384202 -2.7288023 -2.1283144 ] [ 1.6327697 0.0530935 -2.8850526 ] [ 0.9952179 -1.0867816 8.5151223 ] [ -1.6003031 -2.4017406 -5.9276216 ] [ 5.7844877 3.8775672 -0.6114671 ] [ -2.5255767 7.3293791 2.9497352 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.173596899822315e-08 -8.079320625574299e-09 1.403477892204588e-10 ] [ 4.868085848713606e-09 -4.372023283865457e-09 -3.409935601485729e-09 ] [ 2.61598546204319e-09 8.506516511727899e-11 -4.622363863580948e-09 ] [ 1.594514865118548e-09 -1.741216085781134e-09 1.364272998471234e-08 ] [ -2.563968234137765e-09 -3.848012670249141e-09 -9.497096822713695e-09 ] [ 9.267771032600401e-09 6.212547564604804e-09 -9.796783000797414e-10 ] [ -4.046419976114827e-09 1.174295993574795e-08 4.725996813927316e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.707859 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.99732945619666e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2740666 2.3987744 3.4281414 ] [ 5.8951126 2.2044419 0.9312889 ] [ 4.6300617 1.5913537 3.0794681 ] [ 5.3941822 3.9838102 2.7128038 ] [ 3.4962065 3.0306633 1.3230771 ] [ 4.1699468 3.3508547 4.8163164 ] [ 3.0373326 4.7885568 3.0618873 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2740666e-10 2.3987744e-10 3.4281414e-10 ] [ 5.8951126e-10 2.2044419e-10 9.312889e-11 ] [ 4.6300617e-10 1.5913537e-10 3.0794681e-10 ] [ 5.3941822e-10 3.9838102e-10 2.7128038e-10 ] [ 3.4962065e-10 3.0306633e-10 1.3230771e-10 ] [ 4.1699468e-10 3.3508547e-10 4.8163164e-10 ] [ 3.0373326e-10 4.7885568e-10 3.0618873e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.52e-05 -7.51e-05 3.5e-05 ] [ -4.67e-05 -4.2e-06 5.33e-05 ] [ 1.46e-05 2.97e-05 -6.44e-05 ] [ 5.29e-05 1.2e-05 -8.06e-05 ] [ 1.17e-05 -5.6e-06 -1.01e-05 ] [ -7.16e-05 -3.6e-05 9.92e-05 ] [ 2.39e-05 7.92e-05 -3.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.43530848368e-14 -1.203234652134e-13 5.607618218999999e-14 ] [ -7.482164880779999e-14 -6.729141862799999e-15 8.53960145922e-14 ] [ 2.33917788564e-14 4.75846460298e-14 -1.031801752296e-13 ] [ 8.475514393859999e-14 1.9226119608e-14 -1.291354367004e-13 ] [ 1.87454666178e-14 -8.972189150399999e-15 -1.61819840034e-14 ] [ -1.147158469944e-13 -5.7678358824e-14 1.589359220928e-13 ] [ 3.82920215526e-14 1.268923894128e-13 -5.19105229416e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.837867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.139682677979968e-18 } }