{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.6798887 -18.0078214 -40.5991458 ] [ -3.8198616 0.7441682 4.6732166 ] [ -3.0516806 -8.9781221 1.685498 ] [ -2.3322443 17.8147301 5.5323663 ] [ 42.8836752 8.4270452 28.7080649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.396113026628611e-08 -2.885171043862193e-08 -6.504700222521052e-08 ] [ -6.120092950211682e-09 1.192288891982818e-09 7.487318380454465e-09 ] [ -4.889331311468917e-09 -1.43845373273078e-08 2.700465490005158e-09 ] [ -3.736667291454062e-09 2.854234407208204e-08 8.863827943561798e-09 ] [ 6.870722181942076e-08 1.350161480186486e-08 4.599539041118909e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3649762 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.595639438788425e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3659833 2.4685157 -0.3141613 ] [ 1.9629261 2.9407237 3.3328283 ] [ 2.3134728 0.8783352 1.762268 ] [ 2.0154396 4.5309042 1.2563992 ] [ 4.1732951 2.8958509 1.7065858 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3659833e-10 2.4685157e-10 -3.141613e-11 ] [ 1.9629261e-10 2.9407237e-10 3.3328283e-10 ] [ 2.3134728e-10 8.783352e-11 1.762268e-10 ] [ 2.0154396e-10 4.5309042e-10 1.2563992e-10 ] [ 4.1732951e-10 2.8958509e-10 1.7065858e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.2e-06 -4e-06 -2.3e-06 ] [ -2.7e-06 7e-07 2.8e-06 ] [ -1.8e-06 -8e-07 -2.2e-06 ] [ -3.8e-06 4.4e-06 1.1e-06 ] [ 9.5e-06 -2e-07 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.92261194496e-15 -6.4087064832e-15 -3.68500622784e-15 ] [ -4.32587687616e-15 1.12152363456e-15 4.48609453824e-15 ] [ -2.88391791744e-15 -1.28174129664e-15 -3.52478856576e-15 ] [ -6.08827115904e-15 7.04957713152e-15 1.76239428288e-15 ] [ 1.52206778976e-14 -3.2043532416e-16 9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -16.806069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.692629083935164e-18 } }