{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.70262 -1.798695 -4.2124032 ] [ -6.1411555 -9.4812426 4.2328394 ] [ -0.4103127 2.5938641 -1.3446565 ] [ -2.0283726 0.6944454 -0.6969009 ] [ 1.1302198 -1.1156804 -0.2476103 ] [ -0.441115 0.7631308 0.3102512 ] [ 9.593356 8.3441779 1.9584802 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72789798058108e-09 -2.88182710069263e-09 -6.749013980026828e-09 ] [ -9.839215847860585e-09 -1.519062535500541e-08 6.781756382154578e-09 ] [ -6.573934205734517e-10 4.155828452791438e-09 -2.154377225056221e-09 ] [ -3.249811184765828e-09 1.112624193468784e-09 -1.11655833819357e-09 ] [ 1.810811754844153e-09 -1.787517067891773e-09 -3.967154369977301e-10 ] [ -7.067441459069099e-10 1.222670336445727e-09 4.970772233104608e-10 ] [ 1.53702508248437e-08 1.336884686131919e-08 3.137831214591646e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.621063 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.823205540484194e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7721539 1.9960075 3.0145517 ] [ 2.2887685 1.4050297 5.4127544 ] [ 3.0357419 4.5612615 3.0160712 ] [ 1.3285797 3.5066868 4.5059351 ] [ 4.6746543 1.2474897 1.6933392 ] [ 3.6414444 3.2888807 1.0530905 ] [ 3.8038134 3.2971011 5.0131774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7721539e-10 1.9960075e-10 3.0145517e-10 ] [ 2.2887685e-10 1.4050297e-10 5.4127544e-10 ] [ 3.0357419e-10 4.5612615e-10 3.0160712e-10 ] [ 1.3285797e-10 3.506686800000001e-10 4.505935100000001e-10 ] [ 4.674654300000001e-10 1.2474897e-10 1.6933392e-10 ] [ 3.6414444e-10 3.2888807e-10 1.0530905e-10 ] [ 3.8038134e-10 3.2971011e-10 5.0131774e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.17e-05 7.2e-06 1.87e-05 ] [ 5.4e-06 1.5e-05 -2e-07 ] [ 1.21e-05 -1.09e-05 -1.49e-05 ] [ 7.4e-06 -1.45e-05 1.7e-05 ] [ -3.2e-06 1.59e-05 -8.1e-06 ] [ 1.55e-05 -2.4e-06 -2.07e-05 ] [ -2.56e-05 -1.02e-05 8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.87454666178e-14 1.15356717648e-14 2.99607030558e-14 ] [ 8.6517538236e-15 2.403264951e-14 -3.204353268e-16 ] [ 1.93863372714e-14 -1.74637253106e-14 -2.38724318466e-14 ] [ 1.18561070916e-14 -2.3231561193e-14 2.723700277799999e-14 ] [ -5.1269652288e-15 2.54746084806e-14 -1.29776307354e-14 ] [ 2.4833737827e-14 -3.845223921599999e-15 -3.316505632379999e-14 ] [ -4.10157218304e-14 -1.63422016668e-14 1.32980660622e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.837363 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.338513611277614e-18 } }