{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0840437 -2.1101235 -3.1083309 ] [ -1.4605065 1.7129522 0.2021953 ] [ 4.0335822 2.0722301 -3.724231 ] [ -2.856502 -5.0852691 0.374546 ] [ 2.2998396 -2.4084437 0.9250316 ] [ 1.386135 3.8938332 4.8711303 ] [ -0.3185046 1.9248208 0.4596586 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.94118271366553e-09 -3.380790538700669e-09 -4.980095097690223e-09 ] [ -2.339989368826435e-09 2.744451967387926e-09 3.239525824956422e-10 ] [ 6.46251109891503e-09 3.320078619138046e-09 -5.966875838658605e-09 ] [ -4.576620721668441e-09 -8.147499262496657e-09 6.000888446141568e-10 ] [ 3.684749238710023e-09 -3.858752188653049e-09 1.482064003021217e-09 ] [ 2.220833090272608e-09 6.23860851833485e-09 7.80441108353049e-09 ] [ -5.103006237372557e-10 3.083902884989553e-09 7.364542624696588e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.572121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.014275834006872e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1151644 1.9787636 1.1175712 ] [ 2.272417 3.9645761 2.1413798 ] [ 5.3683772 2.7709475 1.5145446 ] [ 3.4050742 0.3794416 2.8668502 ] [ 5.4749402 1.3882264 3.4991957 ] [ 4.9266467 3.3003528 4.8201818 ] [ 4.4679643 4.575596 2.8541693 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1151644e-10 1.9787636e-10 1.1175712e-10 ] [ 2.272417e-10 3.9645761e-10 2.1413798e-10 ] [ 5.368377200000001e-10 2.7709475e-10 1.5145446e-10 ] [ 3.4050742e-10 3.794416e-11 2.8668502e-10 ] [ 5.4749402e-10 1.3882264e-10 3.4991957e-10 ] [ 4.926646700000001e-10 3.3003528e-10 4.8201818e-10 ] [ 4.4679643e-10 4.575596e-10 2.8541693e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.52e-05 -2.5e-06 -2e-07 ] [ 8e-07 -1.4e-05 -2.32e-05 ] [ -2.7e-05 1.5e-06 2.65e-05 ] [ -1.71e-05 2.04e-05 1.67e-05 ] [ 6e-06 7.2e-06 -2.8e-05 ] [ 1.8e-05 -1.85e-05 4.1e-06 ] [ -5.8e-06 5.9e-06 4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.037485084416e-14 -4.005441552e-15 -3.2043532416e-16 ] [ 1.28174129664e-15 -2.24304726912e-14 -3.717049760256e-14 ] [ -4.32587687616e-14 2.4032649312e-15 4.24576804512e-14 ] [ -2.739722021568e-14 3.268440306432e-14 2.675634956736e-14 ] [ 9.6130597248e-15 1.153567166976e-14 -4.48609453824e-14 ] [ 2.88391791744e-14 -2.96402674848e-14 6.568924145279999e-15 ] [ -9.292624400640001e-15 9.45284206272e-15 6.568924145279999e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.102918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.06062486086595e-18 } }