{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5178768 0.1602588 0.5935764 ] [ 0.4933098 1.000634 2.761993 ] [ 1.438085 2.624316 0.8145388 ] [ 2.471365 1.192312 0.8679319 ] [ 2.522268 2.85035 2.866422 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.178768e-11 1.602588e-11 5.935764e-11 ] [ 4.933098e-11 1.000634e-10 2.761993e-10 ] [ 1.438085e-10 2.624316e-10 8.145388e-11 ] [ 2.471365e-10 1.192312e-10 8.679319e-11 ] [ 2.522268e-10 2.85035e-10 2.866422e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2704286 -1.1707532 -0.566031 ] [ -1.1512986 -0.1176738 2.2086221 ] [ -4.1718364 7.1756323 -1.0416794 ] [ 6.8839698 -5.3146837 -0.5417287 ] [ -0.2904064 -0.5725216 -0.059183 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.035451018085332e-09 -1.875753421220729e-09 -9.068816423196537e-10 ] [ -1.844583715676912e-09 -1.885342127939892e-10 3.538602721956011e-09 ] [ -6.684018800950677e-09 1.149663040523568e-08 -1.668954394799139e-09 ] [ 1.102933556272165e-08 -8.515062041240665e-09 -8.679450651071957e-10 ] [ -4.652823484440575e-10 -9.172807299802943e-10 -9.482161973002198e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -8.403517232689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.346391895363173e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.651724 0.6242521 0.6261354 ] [ 0.5587186 0.9717041 2.9814427 ] [ 0.9204294 2.9911963 0.6733287 ] [ 2.9865894 0.7338273 1.0879055 ] [ 2.3254432 2.5068911 2.5356498 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.51724e-11 6.242521e-11 6.261354e-11 ] [ 5.587186e-11 9.717041e-11 2.9814427e-10 ] [ 9.204294e-11 2.9911963e-10 6.733287e-11 ] [ 2.9865894e-10 7.338273e-11 1.0879055e-10 ] [ 2.3254432e-10 2.5068911e-10 2.5356498e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.91e-05 -3.9e-06 -2.05e-05 ] [ 1.07e-05 -2.59e-05 1.77e-05 ] [ 9.9e-06 1.01e-05 -1.8e-05 ] [ 7.6e-06 -1.28e-05 3.9e-06 ] [ 9e-07 3.25e-05 1.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.66233400494e-14 -6.248488872599999e-15 -3.2844620997e-14 ] [ 1.71432899838e-14 -4.149637482059999e-14 2.83585264218e-14 ] [ 1.58615486766e-14 1.61819840034e-14 -2.8839179412e-14 ] [ 1.21765424184e-14 -2.05078609152e-14 6.248488872599999e-15 ] [ 1.4419589706e-15 5.207074060499999e-14 2.70767851146e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }