{ "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" [ [ 1.040169 0.3467498 1.049872 ] [ 0.0600036 1.405044 1.572488 ] [ 2.420904 2.65585 0.1683769 ] [ 1.553585 1.595169 0.3590691 ] [ 2.059971 2.654503 2.612695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.040169e-10 3.467498e-11 1.049872e-10 ] [ 6.00036e-12 1.405044e-10 1.572488e-10 ] [ 2.420904e-10 2.65585e-10 1.683769e-11 ] [ 1.553585e-10 1.595169e-10 3.590691e-11 ] [ 2.059971e-10 2.654503e-10 2.612695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.4766164 -97.649891 13.4463989 ] [ -43.0970788 34.8011047 27.9974457 ] [ 65.2473023 83.822853 -16.1589058 ] [ -26.000134 -21.5466203 -24.6493027 ] [ -0.6267059 0.5725536 -0.6356361 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.172330195461197e-09 -1.564523736728469e-07 2.15435061290233e-08 ] [ -6.904913264701675e-08 5.575751678772758e-08 4.485685331222377e-08 ] [ 1.045377031765945e-07 1.342990164718168e-07 -2.588942130376707e-08 ] [ -4.165680717566895e-08 -3.452149158633007e-08 -3.94925368303331e-08 ] [ -1.004093549369941e-09 9.173319996325823e-10 -1.018401307146887e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 42.303953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.77784050224342e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1259436 -0.3685142 1.1287069 ] [ 0.1230927 1.646318 1.904724 ] [ 2.8469211 2.8706627 0.4866985 ] [ 1.1455308 1.5249227 -0.3141959 ] [ 1.8931443 2.9839265 2.5565675 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1259436e-10 -3.685142e-11 1.1287069e-10 ] [ 1.230927e-11 1.646318e-10 1.904724e-10 ] [ 2.8469211e-10 2.8706627e-10 4.866985e-11 ] [ 1.1455308e-10 1.5249227e-10 -3.141959e-11 ] [ 1.8931443e-10 2.9839265e-10 2.5565675e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-06 1.25e-05 1.5e-06 ] [ -7e-07 -1.62e-05 -5.44e-05 ] [ 3.8e-06 1.89e-05 6.8e-06 ] [ -3.25e-05 -3.27e-05 1.32e-05 ] [ 3.34e-05 1.75e-05 3.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706535999999e-15 2.0027207925e-14 2.403264951e-15 ] [ -1.1215236438e-15 -2.59552614708e-14 -8.71584088896e-14 ] [ 6.088271209199999e-15 3.02811383826e-14 1.08948011112e-14 ] [ -5.207074060499999e-14 -5.23911759318e-14 2.11487315688e-14 ] [ 5.351269957559999e-14 2.8038091095e-14 5.255139359519999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.985955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.240797030517547e-18 } }