{ "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" [ [ 0.7145242 0.8187554 1.873184 ] [ 0.3169354 2.259423 0.2511792 ] [ 1.412151 2.902885 2.703929 ] [ 2.136626 0.3772665 0.2243012 ] [ 2.65148 2.117604 0.8383983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.145242000000001e-11 8.187554e-11 1.873184e-10 ] [ 3.169354e-11 2.259423e-10 2.511792e-11 ] [ 1.412151e-10 2.902885e-10 2.703929e-10 ] [ 2.136626e-10 3.772665e-11 2.243012e-11 ] [ 2.65148e-10 2.117604e-10 8.383983000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.1376334 -11.5904633 10.4882261 ] [ -12.3315589 7.6222757 -10.6680509 ] [ -0.0744788 10.3964036 12.7338956 ] [ 5.9184776 -15.5185932 -10.1078127 ] [ 15.6251934 9.0903771 -2.446258 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.464010260292122e-08 -1.856996932350042e-08 1.680399065108436e-08 ] [ -1.975733536759816e-08 1.221223192383196e-08 -1.70921017414844e-08 ] [ -1.19328192105239e-10 1.665687478832096e-08 2.040194982202799e-08 ] [ 9.482446441448494e-09 -2.486352721274586e-08 -1.619450119536532e-08 ] [ 2.503431956095847e-08 1.45643896638757e-08 -3.919337376044966e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 86.630221 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.387969147409372e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.1759791 -2.8059316 4.9733458 ] [ -2.6894873 4.1492329 -2.5351492 ] [ 0.9384583 6.4958259 6.9169469 ] [ 3.649023 -4.1013293 -3.0510727 ] [ 7.5097016 4.7381359 -0.4130791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.1759791e-10 -2.8059316e-10 4.9733458e-10 ] [ -2.6894873e-10 4.1492329e-10 -2.5351492e-10 ] [ 9.384583e-11 6.4958259e-10 6.9169469e-10 ] [ 3.649023e-10 -4.1013293e-10 -3.0510727e-10 ] [ 7.5097016e-10 4.7381359e-10 -4.130791e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 3.5527137e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.692074830535866e-34 } }