{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.399657 8.8388259 5.9329092 ] [ 10.8874666 -4.786812 -9.7781475 ] [ -3.325991 -11.8705384 -6.7909934 ] [ 3.7296685 -2.6022315 4.3537367 ] [ -4.536339 -8.3639512 10.593297 ] [ -2.3474316 3.9961025 -7.8690715 ] [ 6.9922835 14.7886047 3.5582696 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.826426393053907e-08 1.416136021230152e-08 9.505568413569232e-09 ] [ 1.744364444626086e-08 -7.66931827456489e-09 -1.566631931923397e-08 ] [ -5.328825021191213e-09 -1.901869910078864e-08 -1.08803708574871e-08 ] [ 5.975587674034205e-09 -4.169234471209315e-09 6.975455153858943e-09 ] [ -7.268016289823251e-09 -1.340052707015211e-08 1.697233279059078e-08 ] [ -3.761000028447137e-09 6.402461999820432e-09 -1.260764238470359e-08 ] [ 1.12028731497056e-08 2.3693956704593e-08 5.700976363623368e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.140205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.304204613951926e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8005612 4.1235472 3.4152959 ] [ 5.5062007 2.7029467 1.6428134 ] [ 3.3942702 1.1076292 1.8634854 ] [ 5.5243917 2.188879 4.2484536 ] [ 3.1569729 1.835026 4.1344869 ] [ 3.0237837 3.4863787 1.1159379 ] [ 5.1539255 4.5676311 3.5009365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8005612e-10 4.1235472e-10 3.4152959e-10 ] [ 5.5062007e-10 2.7029467e-10 1.6428134e-10 ] [ 3.3942702e-10 1.1076292e-10 1.8634854e-10 ] [ 5.5243917e-10 2.188879e-10 4.2484536e-10 ] [ 3.1569729e-10 1.835026e-10 4.1344869e-10 ] [ 3.0237837e-10 3.4863787e-10 1.1159379e-10 ] [ 5.1539255e-10 4.5676311e-10 3.5009365e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.64e-05 -6.44e-05 2.66e-05 ] [ 1.49e-05 -2.15e-05 -4.98e-05 ] [ 1.58e-05 5.38e-05 2.79e-05 ] [ -4.61e-05 -3.51e-05 3.3e-06 ] [ 1.12e-05 5.6e-05 -2.28e-05 ] [ 3.57e-05 -1.22e-05 3.99e-05 ] [ -4.8e-05 2.35e-05 -2.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.627569658112e-14 -1.0318017437952e-13 4.261789811328e-14 ] [ 2.387243164992e-14 -3.44467973472e-14 -7.978839571583999e-14 ] [ 2.531439060864e-14 8.619710219904001e-14 4.470072772032e-14 ] [ -7.386034221888001e-14 -5.623639939008e-14 5.28718284864e-15 ] [ 1.794437815296e-14 8.97218907648e-14 -3.652962695424e-14 ] [ 5.719770536256001e-14 -1.954655477376e-14 6.392684716992e-14 ] [ -7.69044777984e-14 3.76511505888e-14 -4.037485084416e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.765666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846373471814145e-18 } }