{ "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" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4663511 0.8351973 0.3074303 ] [ 0.8006125 -0.7783069 -0.448406 ] [ -4.5829555 -2.2455982 1.638547 ] [ -0.9766059 0.0884779 -0.8147427 ] [ 4.2925978 2.1002298 -0.6828286 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.471768295043629e-10 1.338133587815284e-09 4.925576391855302e-10 ] [ 1.28272262982024e-09 -1.246985118987324e-09 -7.184256098264448e-10 ] [ -7.342704156266774e-09 -3.597844935750562e-09 2.625241695481978e-09 ] [ -1.564695140715343e-09 1.417572228374803e-10 -1.305361705907468e-09 ] [ 6.877499837657515e-09 3.36493908386746e-09 -1.094012018933595e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.05574139923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.498014049864917e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8363439 2.3973498 1.7657642 ] [ 4.8284412 1.7766985 2.8557758 ] [ 3.0991588 2.8338812 4.0760832 ] [ 3.1162369 4.6114402 2.5149293 ] [ 5.1083363 3.9907894 3.6049395 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8363439e-10 2.3973498e-10 1.7657642e-10 ] [ 4.8284412e-10 1.7766985e-10 2.8557758e-10 ] [ 3.0991588e-10 2.8338812e-10 4.0760832e-10 ] [ 3.1162369e-10 4.6114402e-10 2.5149293e-10 ] [ 5.1083363e-10 3.9907894e-10 3.6049395e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.13e-05 -6.5e-06 -7.8e-06 ] [ 7.1e-06 -7e-06 1.3e-06 ] [ 2.7e-06 7.8e-06 -5.6e-06 ] [ 2.2e-06 3e-07 7.2e-06 ] [ -8e-07 5.4e-06 5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.810459581504e-14 -1.04141480352e-14 -1.249697764224e-14 ] [ 1.137545400768e-14 -1.12152363456e-14 2.08282960704e-15 ] [ 4.32587687616e-15 1.249697764224e-14 -8.972189076479999e-15 ] [ 3.52478856576e-15 4.8065298624e-16 1.153567166976e-14 ] [ -1.28174129664e-15 8.65175375232e-15 8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }