{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9589965 -1.4023167 -1.2159761 ] [ -1.840496 1.2774085 1.3703805 ] [ -0.9714633 -0.5184001 -5.096342 ] [ 3.1044728 -3.3217338 2.003093 ] [ 0.6664831 3.9650421 2.9388445 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.536481784387781e-09 -2.246759050207987e-09 -1.948208494922447e-09 ] [ -2.948799686170464e-09 2.046634050772989e-09 2.195591616789237e-09 ] [ -1.556455800048532e-09 -8.305685272832633e-10 -8.165240071272827e-09 ] [ 4.973913781048555e-09 -5.322004278728028e-09 3.209308800328961e-09 ] [ 1.067823649775885e-09 6.352697805446291e-09 4.708547988859412e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.814597 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.89290712535265e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4472048 0.894598 0.8084651 ] [ 2.3399557 2.2012991 2.8188452 ] [ 4.0646019 2.4196198 -0.0964774 ] [ 4.4467697 1.38638 2.0281932 ] [ 3.9573699 3.7263084 1.9139144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4472048e-10 8.945980000000001e-11 8.084651000000001e-11 ] [ 2.3399557e-10 2.2012991e-10 2.8188452e-10 ] [ 4.064601900000001e-10 2.4196198e-10 -9.647740000000001e-12 ] [ 4.4467697e-10 1.38638e-10 2.0281932e-10 ] [ 3.957369900000001e-10 3.726308400000001e-10 1.9139144e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-06 -1.4e-06 4.8e-06 ] [ 9.2e-06 -2.02e-05 7.1e-06 ] [ 1.67e-05 7.2e-06 1.6e-06 ] [ -2.09e-05 5.9e-06 1.7e-06 ] [ 4e-06 8.5e-06 -1.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.4419589706e-14 -2.2430472876e-15 7.690447843199998e-15 ] [ 1.47400250328e-14 -3.236396800679999e-14 1.13754541014e-14 ] [ 2.67563497878e-14 1.15356717648e-14 2.5634826144e-15 ] [ -3.34854916506e-14 9.452842140600001e-15 2.7237002778e-15 ] [ 6.408706535999999e-15 1.3618501389e-14 -2.43530848368e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }