{ "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" [ [ 2.167127 3.726278 2.425808 ] [ 5.703742 2.419847 2.282123 ] [ 3.651151 2.438119 0.811047 ] [ 3.941822 0.8653656 2.619853 ] [ 4.06698 3.157982 3.365965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.167127e-10 3.726278000000001e-10 2.425808e-10 ] [ 5.703742000000001e-10 2.419847e-10 2.282123e-10 ] [ 3.651151e-10 2.438119e-10 8.11047e-11 ] [ 3.941822e-10 8.653656e-11 2.619853e-10 ] [ 4.06698e-10 3.157982e-10 3.365965e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6214249 -0.1116185 -2.1272772 ] [ 16.7664018 4.9835526 -1.8010855 ] [ -5.8084502 3.9101729 -5.2478852 ] [ -7.6633978 -18.2050978 2.4434326 ] [ -2.6731289 9.4229907 6.7328153 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.95632446362978e-10 -1.788325511487648e-10 -3.408273795800886e-09 ] [ 2.686273697889904e-08 7.984531464247055e-09 -2.885657080161878e-09 ] [ -9.306163113521084e-09 6.264787603665736e-09 -8.408038976082333e-09 ] [ -1.227811679105016e-08 -2.916778207453751e-08 3.914810586220558e-09 ] [ -4.282824627964821e-09 1.509729539755582e-08 1.078715926582454e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.695317 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.034014009104479e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1815152 4.0463917 2.174567 ] [ 5.8298969 2.5016143 2.0587728 ] [ 3.5289318 2.4205353 1.0120893 ] [ 4.1349681 0.6380916 2.7009279 ] [ 3.8555101 3.0009587 3.5584389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1815152e-10 4.0463917e-10 2.174567e-10 ] [ 5.829896899999999e-10 2.5016143e-10 2.0587728e-10 ] [ 3.5289318e-10 2.4205353e-10 1.0120893e-10 ] [ 4.1349681e-10 6.380916e-11 2.7009279e-10 ] [ 3.8555101e-10 3.0009587e-10 3.5584389e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.9e-05 7.2e-06 -1.14e-05 ] [ 1.83e-05 8.2e-06 -2.35e-05 ] [ -2.58e-05 -5.9e-06 1.02e-05 ] [ 1.85e-05 -1.14e-05 -3.6e-06 ] [ -5.01e-05 1.8e-06 2.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.248488821120001e-14 1.153567166976e-14 -1.826481347712e-14 ] [ 2.931983216064e-14 1.313784829056e-14 -3.76511505888e-14 ] [ -4.133615681664e-14 -9.45284206272e-15 1.634220153216e-14 ] [ 2.96402674848e-14 -1.826481347712e-14 -5.76783583488e-15 ] [ -8.026904870208e-14 2.88391791744e-15 4.534159836864e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.808942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693089389278319e-18 } }