{ "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" [ [ 0.4147919 0.1188417 2.672415 ] [ 0.6892124 1.667561 0.0898235 ] [ 0.5303116 1.702107 2.13154 ] [ 2.147495 1.160279 2.850921 ] [ 1.555523 2.957039 1.141113 ] [ 2.952569 2.336763 2.431712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.147919e-11 1.188417e-11 2.672415e-10 ] [ 6.892124e-11 1.667561e-10 8.98235e-12 ] [ 5.303116e-11 1.702107e-10 2.13154e-10 ] [ 2.147495e-10 1.160279e-10 2.850921e-10 ] [ 1.555523e-10 2.957039e-10 1.141113e-10 ] [ 2.952569e-10 2.336763e-10 2.431712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.0867555 -12.296726 0.5650189 ] [ -1.5351698 -5.390138 -10.3105245 ] [ -42.3470676 -0.5181769 4.3787938 ] [ 19.3560695 -18.8105455 20.7652545 ] [ 2.0597881 26.9702192 -18.2372704 ] [ 29.5531353 10.0453672 2.8387277 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.135423397942581e-08 -1.97015269095835e-08 9.052600718901332e-10 ] [ -2.459613162518212e-09 -8.63595308648567e-09 -1.651928130208561e-08 ] [ -6.784748166815717e-08 -8.302109146186197e-10 7.015601053663992e-09 ] [ 3.101184202347995e-08 -3.013781622459465e-08 3.326960528486199e-08 ] [ 3.300144337622052e-09 4.321105466009128e-08 -2.921932826208787e-08 ] [ 4.73493424489992e-08 1.609445247519116e-08 4.548143153757356e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.6655776 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.388378583644818e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7596082 -0.4584335 2.8470408 ] [ 0.5983538 1.9012051 -0.3747986 ] [ -0.2373672 1.5474411 1.886977 ] [ 1.7675558 1.6733878 3.4623409 ] [ 1.6645492 3.1805948 1.4044123 ] [ 3.7372031 2.0983954 2.0915522 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.596082e-11 -4.584335e-11 2.8470408e-10 ] [ 5.983538e-11 1.9012051e-10 -3.747986e-11 ] [ -2.373672e-11 1.5474411e-10 1.886977e-10 ] [ 1.7675558e-10 1.6733878e-10 3.4623409e-10 ] [ 1.6645492e-10 3.1805948e-10 1.4044123e-10 ] [ 3.7372031e-10 2.0983954e-10 2.0915522e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-07 2.62e-05 -3.5e-06 ] [ -8e-06 -1.07e-05 -3.64e-05 ] [ -4.16e-05 -4.74e-05 2.22e-05 ] [ -8.4e-06 -2.28e-05 2.98e-05 ] [ 4.76e-05 5.36e-05 -3.2e-06 ] [ 9.6e-06 1e-06 -8.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-15 4.197702746496e-14 -5.6076181728e-15 ] [ -1.28174129664e-14 -1.714328984256e-14 -5.831922899712e-14 ] [ -6.665054742528e-14 -7.594317182591999e-14 3.556832098176e-14 ] [ -1.345828361472e-14 -3.652962695424e-14 4.774486329984001e-14 ] [ 7.626360715008e-14 8.587666687488e-14 -5.126965186560001e-15 ] [ 1.538089555968e-14 1.6021766208e-15 -1.409915426304e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.097371 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.219953795574392e-18 } }