{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0909404 0.3504436 2.335509 ] [ 2.174921 0.6476227 0.0631824 ] [ 2.07151 0.3484765 2.894541 ] [ 2.345183 1.577217 1.820601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.09404e-12 3.504436000000001e-11 2.335509e-10 ] [ 2.174921e-10 6.476227e-11 6.31824e-12 ] [ 2.07151e-10 3.484765e-11 2.894541e-10 ] [ 2.345183e-10 1.577217e-10 1.820601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.0517153 -5.2013177 3.7439419 ] [ 3.2826026 -2.3780556 -21.2103825 ] [ 3.1863745 -20.1052726 28.6593465 ] [ 13.5827383 27.6846459 -11.1929059 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.212638946059766e-08 -8.333429616293229e-09 5.998456181813531e-09 ] [ 5.259309141097294e-09 -3.810065085282517e-09 -3.398277895972546e-08 ] [ 5.10513472901329e-09 -3.221219771453083e-08 4.591733492970631e-08 ] [ 2.176194575070474e-08 4.435569241610657e-08 -1.793301215179438e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.2720435 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.485545132274061e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3618247 -0.0586981 2.6628775 ] [ 2.306097 0.8547938 -0.4837208 ] [ 1.848676 0.423093 3.3046915 ] [ 2.8896061 1.7045711 1.6299852 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.618247e-11 -5.869810000000001e-12 2.6628775e-10 ] [ 2.306097e-10 8.547938e-11 -4.837208e-11 ] [ 1.848676e-10 4.23093e-11 3.3046915e-10 ] [ 2.8896061e-10 1.7045711e-10 1.6299852e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.16e-05 1.88e-05 -2.01e-05 ] [ -1.8e-06 -1.8e-06 1.26e-05 ] [ 9.3e-06 -1.12e-05 1.58e-05 ] [ -2.91e-05 -5.9e-06 -8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.460701500928e-14 3.012092047104e-14 -3.220375007808e-14 ] [ -2.88391791744e-15 -2.88391791744e-15 2.018742542208e-14 ] [ 1.490024257344e-14 -1.794437815296e-14 2.531439060864e-14 ] [ -4.662333966527999e-14 -9.45284206272e-15 -1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.5046 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.042151804765568e-18 } }