{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.568559 6.8837714 0.7894837 ] [ 2.2603441 -1.25677 -1.6869433 ] [ -3.4380317 -6.6213471 0.2040042 ] [ 0.594148 -1.2081924 1.7682596 ] [ 2.7488262 2.176323 -6.3083718 ] [ 6.8562084 3.7451188 -0.5985406 ] [ -1.452936 -3.7189037 5.8321083 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.21261683828504e-08 1.102901769087747e-08 1.264892337063866e-09 ] [ 3.621470501819759e-09 -2.01356752831218e-09 -2.702781138142852e-09 ] [ -5.508334056691297e-09 -1.060856760922366e-08 3.268507624778628e-10 ] [ 9.519300427378318e-10 -1.935737632656382e-09 2.833064213966186e-09 ] [ 4.40410510856701e-09 3.486853858636782e-09 -1.010712589654452e-08 ] [ 1.098485689631452e-08 6.000341832914118e-09 -9.589677638203403e-10 ] [ -2.327860109897424e-09 -5.958340612236145e-09 9.344067645217462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.263105 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.964766029128857e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6257702 5.4370824 2.9330244 ] [ 6.0472222 2.8713154 1.0700547 ] [ 2.923556 2.8592794 2.5164326 ] [ 5.3827611 2.6402641 3.3893439 ] [ 4.2951188 4.5458132 1.0562798 ] [ 5.2040465 5.2527971 3.4082258 ] [ 3.5300651 3.8527584 4.8727939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6257702e-10 5.437082400000001e-10 2.9330244e-10 ] [ 6.0472222e-10 2.8713154e-10 1.0700547e-10 ] [ 2.923556e-10 2.8592794e-10 2.5164326e-10 ] [ 5.3827611e-10 2.6402641e-10 3.3893439e-10 ] [ 4.2951188e-10 4.545813200000001e-10 1.0562798e-10 ] [ 5.2040465e-10 5.2527971e-10 3.4082258e-10 ] [ 3.5300651e-10 3.8527584e-10 4.8727939e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 -1.3e-06 -5.7e-06 ] [ -0.0 1.8e-06 -3.6e-06 ] [ 6.7e-06 8.1e-06 5.4e-06 ] [ -3e-06 -2.1e-06 -9e-07 ] [ 6e-07 -2.5e-06 3.1e-06 ] [ 3.2e-06 1.9e-06 -4.2e-06 ] [ -5.1e-06 -5.9e-06 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.685006258199999e-15 -2.0828296242e-15 -9.1324068138e-15 ] [ 0.0 2.8839179412e-15 -5.767835882399999e-15 ] [ 1.07345834478e-14 1.29776307354e-14 8.6517538236e-15 ] [ -4.806529901999999e-15 -3.364570931399999e-15 -1.4419589706e-15 ] [ 9.613059803999998e-16 -4.005441585e-15 4.9667475654e-15 ] [ 5.1269652288e-15 3.0441356046e-15 -6.729141862799999e-15 ] [ -8.1711008334e-15 -9.452842140600001e-15 9.452842140600001e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.518207 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.646508529097524e-18 } }