{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -34.3580782 -15.9953623 -16.7409036 ] [ 14.3003592 7.5547996 21.0362899 ] [ 7.4784747 14.2241162 -8.27126 ] [ -9.7504172 9.575742 11.9153292 ] [ 23.2667567 -15.5655234 -6.6539968 ] [ -0.9370952 0.2062279 -1.2854587 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.504770962765815e-08 -2.562739551828572e-08 -2.682188435898656e-08 ] [ 2.291170117928219e-08 1.210412329394919e-08 3.370385186615117e-08 ] [ 1.198183732358429e-08 2.278954642718254e-08 -1.325201939655821e-08 ] [ -1.56218904808862e-08 1.534202995921263e-08 1.909046187337557e-08 ] [ 3.727745362658176e-08 -2.493871768199533e-08 -1.066087810783801e-08 ] [ -1.5013920209039e-09 3.304135199366803e-10 -2.059531876143961e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 22.38084886950932 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.585807281238595e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3181273 0.8393353 0.7840303 ] [ 2.6823975 2.206361 1.3859595 ] [ 1.0675389 2.4008887 -0.3378403 ] [ 0.44414 2.7759876 1.9177837 ] [ 1.9201376 0.2696857 0.252215 ] [ 1.2967458 0.6447833 2.5078207 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.181273e-11 8.393353000000001e-11 7.840303e-11 ] [ 2.6823975e-10 2.206361e-10 1.3859595e-10 ] [ 1.0675389e-10 2.4008887e-10 -3.378403e-11 ] [ 4.4414e-11 2.7759876e-10 1.9177837e-10 ] [ 1.9201376e-10 2.696857e-11 2.52215e-11 ] [ 1.2967458e-10 6.447833e-11 2.5078207e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.37e-05 -6.28e-05 -4.37e-05 ] [ 2.08e-05 -1.77e-05 1.55e-05 ] [ -3.16e-05 1.07e-05 3.69e-05 ] [ 2.01e-05 5.47e-05 -2.77e-05 ] [ -3.06e-05 1.31e-05 -3.89e-05 ] [ -2.4e-06 2.1e-06 5.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.797158591296e-14 -1.0061669178624e-13 -7.001511832895999e-14 ] [ 3.332527371264e-14 -2.835852618816e-14 2.48337376224e-14 ] [ -5.062878121728e-14 1.714328984256e-14 5.912031730752001e-14 ] [ 3.220375007808e-14 8.763906115775999e-14 -4.438029239616e-14 ] [ -4.902660459647999e-14 2.098851373248e-14 -6.232467054911999e-14 ] [ -3.84522388992e-15 3.36457090368e-15 9.276602634432e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }