{ "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" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2568031 -13.1984604 -0.2246496 ] [ -2.7226306 -0.7905084 3.4549678 ] [ -6.4221185 0.8969879 -5.0262226 ] [ -3.4597644 15.0202771 3.8665209 ] [ 8.8918171 -0.2531305 -8.5884462 ] [ 8.9694995 -1.6751658 6.5178298 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.422327026968964e-09 -2.114626468343462e-08 -3.599283369920717e-10 ] [ -4.362135094394676e-09 -1.266534077026015e-09 5.53546863477681e-09 ] [ -1.028936811670716e-08 1.437133042520488e-09 -8.05289634065659e-09 ] [ -5.543153635156139e-09 2.406513680755762e-08 6.194849389814575e-09 ] [ 1.424626147404966e-08 -4.055597691114144e-10 -1.37602077106386e-08 ] [ 1.437072239917729e-08 -2.683911480723729e-09 1.044271452391354e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.048925735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.83876687724563e-21 } "relaxed-configuration-positions" { "source-value" [ [ 1.1602323 1.307838 3.1186033 ] [ 2.1027684 2.7016404 4.8702033 ] [ 1.720149 3.1297492 1.6131825 ] [ 1.4049763 4.5977869 3.5222886 ] [ 4.0626264 2.9334458 1.7928338 ] [ 4.3357256 2.6278746 4.1175645 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1602323e-10 1.307838e-10 3.1186033e-10 ] [ 2.1027684e-10 2.7016404e-10 4.870203300000001e-10 ] [ 1.720149e-10 3.1297492e-10 1.6131825e-10 ] [ 1.4049763e-10 4.5977869e-10 3.5222886e-10 ] [ 4.0626264e-10 2.9334458e-10 1.7928338e-10 ] [ 4.3357256e-10 2.6278746e-10 4.1175645e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 1.83e-05 4.8e-06 ] [ -7.6e-06 0.0 -1.99e-05 ] [ 9.2e-06 -5.9e-06 2.4e-05 ] [ -7.6e-06 -1.4e-05 2.3e-06 ] [ 8e-06 -6e-07 -8.6e-06 ] [ 3e-06 2.1e-06 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 2.931983216064e-14 7.69044777984e-15 ] [ -1.217654231808e-14 0.0 -3.188331475392e-14 ] [ 1.474002491136e-14 -9.45284206272e-15 3.84522388992e-14 ] [ -1.217654231808e-14 -2.24304726912e-14 3.68500622784e-15 ] [ 1.28174129664e-14 -9.6130597248e-16 -1.377871893888e-14 ] [ 4.8065298624e-15 3.36457090368e-15 -4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.5540646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53072989357329e-18 } }