{ "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" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.388843 -0.4040007 -2.7067241 ] [ -8.1497866 -1.913787 0.6344976 ] [ 7.5855477 -3.6008384 -2.6571183 ] [ 2.2519534 1.8277041 4.4023312 ] [ -0.2988715 4.0909221 0.3270136 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.225171802894462e-09 -6.472804816596436e-10 -4.33665010770468e-09 ] [ -1.30573976626063e-08 -3.066224813852957e-09 1.016577229049078e-09 ] [ 1.215338728103244e-08 -5.769179147289946e-09 -4.257172854033802e-09 ] [ 3.608027118336855e-09 2.928304802885999e-09 7.05331218376918e-09 ] [ -4.788449338685309e-10 6.554379800134211e-09 5.239335489202224e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3145937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.011709447934361e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4806825 1.4502755 0.0335145 ] [ 2.2963991 1.5481263 4.0111311 ] [ 2.9328829 2.5119872 2.0226212 ] [ 2.6717801 2.3738786 6.1194617 ] [ 4.0217354 4.5374913 2.0232481 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4806825e-10 1.4502755e-10 3.35145e-12 ] [ 2.2963991e-10 1.5481263e-10 4.0111311e-10 ] [ 2.9328829e-10 2.5119872e-10 2.0226212e-10 ] [ 2.6717801e-10 2.3738786e-10 6.119461699999999e-10 ] [ 4.0217354e-10 4.5374913e-10 2.0232481e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.98e-05 -2.41e-05 -2.17e-05 ] [ -2.46e-05 -9.8e-06 3.89e-05 ] [ 5.98e-05 1.41e-05 3.89e-05 ] [ -7.2e-06 -1.59e-05 -4.23e-05 ] [ 1.9e-06 3.57e-05 -1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.77448636932e-14 -3.86124568794e-14 -3.476723295779999e-14 ] [ -3.94135451964e-14 -1.57013310132e-14 6.232467106259999e-14 ] [ 9.581016271319999e-14 2.25906905394e-14 6.232467106259999e-14 ] [ -1.15356717648e-14 -2.54746084806e-14 -6.77720716182e-14 ] [ 3.0441356046e-15 5.719770583379999e-14 -2.21100375492e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.575945 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.694453196146913e-18 } }