{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -35.7926644 -16.0057956 -18.9061551 ] [ -33.1442249 -21.457218 10.9720686 ] [ -19.8960349 36.4080657 -9.6961563 ] [ 37.3163928 -6.432394 -13.905844 ] [ 12.7918655 -16.8249831 7.8838037 ] [ 4.9651881 3.3820986 -2.0904388 ] [ 33.7594778 20.9302264 25.7427218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.734617009782046e-08 -2.564411150762351e-08 -3.029099969043869e-08 ] [ -5.310290224931721e-08 -3.437825302700894e-08 1.757919179273379e-08 ] [ -3.187696196340087e-08 5.833215167309038e-08 -1.553495493548263e-08 ] [ 5.978745211674945e-08 -1.03058312825742e-08 -2.227961814929196e-08 ] [ 2.04948278405181e-08 -2.695659456817511e-08 1.263124597111654e-08 ] [ 7.955108291694373e-09 5.418719306160411e-09 -3.349252172573207e-09 ] [ 5.408864606157662e-08 3.353391940613095e-08 4.124438702371849e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.20175929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.232540174672072e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.368076 2.1312844 1.7025235 ] [ 1.6151838 2.6533991 4.7612549 ] [ 2.4108008 4.4276043 2.9022369 ] [ 4.9829869 2.3805198 1.5855352 ] [ 3.9047533 1.6126786 3.8514078 ] [ 4.6041636 4.89299 1.6668049 ] [ 3.9474046 3.9894877 5.0133847 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.368076e-10 2.1312844e-10 1.7025235e-10 ] [ 1.6151838e-10 2.6533991e-10 4.761254900000001e-10 ] [ 2.4108008e-10 4.4276043e-10 2.9022369e-10 ] [ 4.982986900000001e-10 2.3805198e-10 1.5855352e-10 ] [ 3.9047533e-10 1.6126786e-10 3.8514078e-10 ] [ 4.6041636e-10 4.89299e-10 1.6668049e-10 ] [ 3.9474046e-10 3.989487700000001e-10 5.0133847e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-06 5.9e-06 -3.6e-06 ] [ 2.7e-05 1.48e-05 2.4e-06 ] [ -2.92e-05 -1.63e-05 4.69e-05 ] [ 2.7e-05 3.14e-05 -2.76e-05 ] [ -1.64e-05 2.1e-05 2.7e-05 ] [ 4.24e-05 -2.26e-05 -5.46e-05 ] [ -4.39e-05 -3.42e-05 9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-14 9.45284206272e-15 -5.76783583488e-15 ] [ 4.32587687616e-14 2.371221398784e-14 3.84522388992e-15 ] [ -4.678355732736e-14 -2.611547891904e-14 7.514208351552e-14 ] [ 4.32587687616e-14 5.030834589312e-14 -4.422007473408001e-14 ] [ -2.627569658112e-14 3.36457090368e-14 4.32587687616e-14 ] [ 6.793228872192001e-14 -3.620919163008e-14 -8.747884349568e-14 ] [ -7.033555365312e-14 -5.479444043136e-14 1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.99076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.843743478722382e-18 } }