{ "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" [ [ 1.492003 2.387549 2.170669 ] [ 2.788135 3.420279 0.7006935 ] [ 2.516882 3.82705 3.771673 ] [ 3.610971 1.743132 2.445693 ] [ 4.42605 4.234183 2.406002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.492003e-10 2.387549e-10 2.170669e-10 ] [ 2.788135e-10 3.420279e-10 7.006935e-11 ] [ 2.516882e-10 3.82705e-10 3.771673e-10 ] [ 3.610971e-10 1.743132e-10 2.445693e-10 ] [ 4.42605e-10 4.234183e-10 2.406002e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.1851907 1.9383847 2.4910749 ] [ -0.3501788 0.1909187 -0.3410563 ] [ 8.5810779 0.0588025 -9.6199285 ] [ -1.2074575 -0.0363315 0.1192076 ] [ -10.2086323 -2.1517744 7.3507023 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.103238072329587e-09 3.105634648456422e-09 3.991141965441698e-09 ] [ -5.610482864597991e-10 3.05885477613529e-10 -5.464324302365509e-10 ] [ 1.374840239264356e-08 9.421199074459201e-11 -1.541282453646761e-08 ] [ -1.934560177109616e-09 -5.820947989859521e-11 1.909916297416781e-10 ] [ -1.635603200140373e-08 -3.447522636915948e-09 1.177712337152079e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4344181 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.706897627472358e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5579209 2.4741429 1.8763229 ] [ 1.540267 2.9697824 -0.0161271 ] [ 3.3464238 4.0909038 3.1533929 ] [ 2.8225703 0.3676993 2.4717974 ] [ 4.5668591 5.7096647 4.0093444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5579209e-10 2.4741429e-10 1.8763229e-10 ] [ 1.540267e-10 2.9697824e-10 -1.61271e-12 ] [ 3.3464238e-10 4.090903800000001e-10 3.1533929e-10 ] [ 2.8225703e-10 3.676993e-11 2.4717974e-10 ] [ 4.5668591e-10 5.7096647e-10 4.0093444e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0034874 -0.0006543 -0.0322195 ] [ -0.0004826 -0.0063153 0.0159061 ] [ 0.0278447 0.0274567 0.0097298 ] [ -0.0060635 -0.0074551 0.0056416 ] [ -0.0178112 -0.013032 0.000942 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.58743074737792e-12 -1.04830416298944e-12 -5.16213296338656e-11 ] [ -7.7321043719808e-13 -1.011822601333824e-11 2.548438154810688e-11 ] [ 4.461212735318976e-11 4.399048282431936e-11 1.558885808505984e-11 ] [ -9.714797940220801e-12 -1.194438692572608e-11 9.038839623905281e-12 ] [ -2.853668822839296e-11 -2.08795657222656e-11 1.5092503767936e-12 ] ] } "relaxed-potential-energy" { "source-value" -10.273288 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.645962185234519e-18 } }