{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.247494 -6.2328879 -6.9403883 ] [ -4.8446174 -4.8092468 -16.3098838 ] [ -63.2883044 35.6795043 36.6003155 ] [ 21.7596853 -18.9700708 47.1897578 ] [ -0.5026903 2.784419 -4.2839778 ] [ 60.1234207 -8.4517179 -56.2558233 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.122482517098827e-08 -9.986187273447209e-09 -1.111972787353386e-08 ] [ -7.76193273500088e-09 -7.705262786617215e-09 -2.613131451232467e-08 ] [ -1.013990416797538e-07 5.716486763119307e-08 5.864016980800386e-08 ] [ 3.486285906362543e-08 -3.039340393068075e-08 7.560632668837445e-08 ] [ -8.053986461629384e-10 4.461131024311316e-09 -6.863689075186217e-09 ] [ 9.632833900806277e-08 -1.354114482497687e-08 -9.013176487511591e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 29.943126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.797417643086862e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6423586 -0.0650388 1.0881049 ] [ 0.0597669 2.398625 0.2760231 ] [ 0.5169565 3.050065 2.5980136 ] [ 3.6367551 1.3380127 4.0018032 ] [ 2.6783896 2.6844265 -0.084158 ] [ 1.9825423 1.8382962 2.3013114 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.423586e-11 -6.50388e-12 1.0881049e-10 ] [ 5.97669e-12 2.398625e-10 2.760231e-11 ] [ 5.169565000000001e-11 3.050065e-10 2.5980136e-10 ] [ 3.6367551e-10 1.3380127e-10 4.0018032e-10 ] [ 2.6783896e-10 2.6844265e-10 -8.4158e-12 ] [ 1.9825423e-10 1.8382962e-10 2.3013114e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.35e-05 2.48e-05 -8.3e-05 ] [ 4.2e-06 1.81e-05 -1.66e-05 ] [ 8.54e-05 -6.65e-05 5.06e-05 ] [ 3.55e-05 2.61e-05 5.04e-05 ] [ -3.79e-05 -8.84e-05 -1.88e-05 ] [ -0.0001106 8.6e-05 1.74e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.76511505888e-14 3.973398019584e-14 -1.329806595264e-13 ] [ 6.72914180736e-15 2.899939683648e-14 -2.659613190528e-14 ] [ 1.3682588341632e-13 -1.065447452832e-13 8.107013701248e-14 ] [ 5.68772700384e-14 4.181680980288e-14 8.074970168832e-14 ] [ -6.072249392832e-14 -1.4163241327872e-13 -3.012092047104e-14 ] [ -1.7720073426048e-13 1.377871893888e-13 2.787787320192e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.350659 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.299229034287311e-18 } }