{ "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" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.259301 -8.0749929 1.9990057 ] [ -11.9085448 9.2281502 4.2971744 ] [ 2.7367674 -6.2816229 -7.9514316 ] [ 5.5195887 -0.6183389 13.4907779 ] [ 11.9114896 5.7468044 -11.8355264 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.323285907537283e-08 -1.29375649440959e-08 3.202760223772814e-09 ] [ -1.90795922235022e-08 1.478512662548243e-08 6.884832415902969e-09 ] [ 4.384784780972931e-09 -1.006426943397932e-08 -1.273959791636923e-08 ] [ 8.843356044430434e-09 -9.906881374732625e-10 2.161460912586359e-08 ] [ 1.9084310313254e-08 9.207395729848389e-09 -1.896260384917014e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1312914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.619058549325147e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7634794 1.446108 2.1433242 ] [ 1.228742 3.8231891 3.0445827 ] [ 3.2739528 1.1208592 1.6227694 ] [ 4.7391641 3.1559182 4.6124117 ] [ 3.6186278 3.4147915 2.508594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.634794e-11 1.446108e-10 2.1433242e-10 ] [ 1.228742e-10 3.8231891e-10 3.0445827e-10 ] [ 3.2739528e-10 1.1208592e-10 1.6227694e-10 ] [ 4.7391641e-10 3.1559182e-10 4.6124117e-10 ] [ 3.6186278e-10 3.4147915e-10 2.508594e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.1e-06 1.08e-05 4e-06 ] [ 1.44e-05 -1.32e-05 -4.5e-06 ] [ -8.8e-06 -1.6e-06 -8.3e-06 ] [ -1.59e-05 1.16e-05 -2.06e-05 ] [ 2.2e-06 -7.6e-06 2.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.29776307354e-14 1.73035076472e-14 6.408706535999999e-15 ] [ 2.30713435296e-14 -2.11487315688e-14 -7.209794853e-15 ] [ -1.40991543792e-14 -2.5634826144e-15 -1.32980660622e-14 ] [ -2.54746084806e-14 1.85852489544e-14 -3.300483866039999e-14 ] [ 3.5247885948e-15 -1.21765424184e-14 4.710399303959999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }