{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0243486 -5.9418595 -0.3849839 ] [ -2.461468 4.2075598 -2.9812588 ] [ -2.8829606 1.3340077 5.114145 ] [ -0.1746817 -0.160848 -0.1784771 ] [ 7.5434588 0.5611399 -1.5694253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.243363999269211e-09 -9.519908374978378e-09 -6.168122039644052e-10 ] [ -3.943706482447334e-09 6.741253942177924e-09 -4.776503149914264e-09 ] [ -4.619012072007541e-09 2.13731594890718e-09 8.193763554381215e-09 ] [ -2.798709358215994e-10 -2.577069051024384e-10 -2.859518369681837e-10 ] [ 1.208595332932802e-08 8.9904522877805e-10 -2.514496523752026e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.0153514 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.433302137376549e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4635639 -0.0151541 2.3314499 ] [ 1.014739 3.446503 0.9316011 ] [ -0.5548345 2.046938 1.9412164 ] [ 2.6628841 0.1103304 1.5640435 ] [ 3.0034772 2.2496921 0.6987275 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.635639e-11 -1.51541e-12 2.3314499e-10 ] [ 1.014739e-10 3.446503e-10 9.316011e-11 ] [ -5.548345e-11 2.046938e-10 1.9412164e-10 ] [ 2.6628841e-10 1.103304e-11 1.5640435e-10 ] [ 3.0034772e-10 2.2496921e-10 6.987275e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.75e-05 -5.1e-06 1.25e-05 ] [ 8.1e-06 -1.49e-05 1.83e-05 ] [ -3.5e-06 2.17e-05 -3.04e-05 ] [ -2.25e-05 -2.38e-05 2.4e-06 ] [ -1.95e-05 2.22e-05 -2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.008162327999999e-14 -8.17110076608e-15 2.002720776e-14 ] [ 1.297763062848e-14 -2.387243164992e-14 2.931983216064e-14 ] [ -5.6076181728e-15 3.476723267136e-14 -4.870616927232e-14 ] [ -3.604897396800001e-14 -3.813180357504e-14 3.84522388992e-15 ] [ -3.12424441056e-14 3.556832098176e-14 -4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }