{ "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" [ [ 1.724599 2.153048 2.374712 ] [ 0.8645185 3.613019 0.4039649 ] [ 2.279761 4.306527 2.243044 ] [ 4.11856 1.980977 2.568835 ] [ 3.209467 2.952847 0.6643367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724599e-10 2.153048e-10 2.374712e-10 ] [ 8.645185e-11 3.613019e-10 4.039649e-11 ] [ 2.279761e-10 4.306527e-10 2.243044e-10 ] [ 4.118560000000001e-10 1.980977e-10 2.568835e-10 ] [ 3.209467e-10 2.952847e-10 6.643367000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6138839 -1.1433991 0.0575183 ] [ 0.6768228 -0.479595 0.6939251 ] [ 0.0018982 1.6459624 0.3943095 ] [ -0.3939846 0.0342244 0.1162409 ] [ 0.3291476 -0.0571927 -1.2619939 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.835504324655252e-10 -1.831927306263761e-09 9.215447552816065e-11 ] [ 1.084389666584394e-09 -7.68395896452576e-10 1.111790571806302e-09 ] [ 3.04125166160256e-12 2.637122475995858e-09 6.317534622593376e-10 ] [ -6.312329150752397e-10 5.483353354090752e-11 1.862384523607507e-10 ] [ 5.273525895124301e-10 -9.163280682042816e-11 -2.021937122172213e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0846007754089015 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.146428488461694e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3802722 2.1134945 2.6413521 ] [ 1.1325738 3.2412617 0.5901328 ] [ 2.4931697 4.2191986 2.3140985 ] [ 3.7192943 2.1523476 2.3802636 ] [ 3.4715955 3.2801156 0.3290455 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3802722e-10 2.1134945e-10 2.6413521e-10 ] [ 1.1325738e-10 3.2412617e-10 5.901328e-11 ] [ 2.4931697e-10 4.219198600000001e-10 2.3140985e-10 ] [ 3.7192943e-10 2.1523476e-10 2.3802636e-10 ] [ 3.4715955e-10 3.2801156e-10 3.290455e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.49e-05 -1.01e-05 5.7e-06 ] [ -2.02e-05 1e-06 3.7e-06 ] [ -2.1e-06 1.44e-05 2.2e-06 ] [ 2.19e-05 -6.6e-06 2.9e-06 ] [ 2.52e-05 1.3e-06 -1.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.989419785791999e-14 -1.618198387008e-14 9.13240673856e-15 ] [ -3.236396774016e-14 1.6021766208e-15 5.928053496960001e-15 ] [ -3.36457090368e-15 2.307134333952e-14 3.52478856576e-15 ] [ 3.508766799552e-14 -1.057436569728e-14 4.646312200320001e-15 ] [ 4.037485084416e-14 2.08282960704e-15 -2.32315610016e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }