{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4161004 -6.4684567 -6.9196077 ] [ 1.9138581 7.4031486 0.4585562 ] [ -8.0636029 -0.9423655 -0.4026308 ] [ 1.7316317 -2.6048697 -3.7095486 ] [ 5.4450216 -3.705162 6.1145324 ] [ -2.7993478 5.5606508 0.3052103 ] [ 6.1885397 0.7570545 4.1534881 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.075372815985529e-09 -1.036361009739712e-08 -1.108643368204766e-08 ] [ 3.066338703348708e-09 1.186115160722825e-08 7.346880229628889e-10 ] [ -1.291931604579508e-08 -1.509835972348502e-09 -6.450856545740007e-10 ] [ 2.77437982557616e-09 -4.17346133357031e-09 -5.943352040641372e-09 ] [ 8.72388630727101e-09 -5.93632393267657e-09 9.796560858404115e-09 ] [ -4.485049598647914e-09 8.909144708192817e-09 4.890008070873542e-10 ] [ 9.915133624232646e-09 1.212935020571434e-09 6.654621528591012e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.614275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.021029649334192e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5291167 1.6602791 2.5000944 ] [ 2.4336655 4.6636144 3.9474711 ] [ 0.7985177 3.2734663 2.8813957 ] [ 3.9675384 2.8480379 0.9953084 ] [ 3.7591908 2.6511889 4.3678858 ] [ 3.8935569 5.1753529 2.1168864 ] [ 5.5775291 3.3800503 2.9754413 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5291167e-10 1.6602791e-10 2.5000944e-10 ] [ 2.4336655e-10 4.6636144e-10 3.9474711e-10 ] [ 7.985177e-11 3.2734663e-10 2.8813957e-10 ] [ 3.9675384e-10 2.8480379e-10 9.953084e-11 ] [ 3.7591908e-10 2.6511889e-10 4.3678858e-10 ] [ 3.8935569e-10 5.175352900000001e-10 2.1168864e-10 ] [ 5.5775291e-10 3.3800503e-10 2.9754413e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.9e-06 1.44e-05 2.02e-05 ] [ -1.78e-05 -3.04e-05 -4.2e-06 ] [ 8.3e-06 6e-06 -8.7e-06 ] [ -2.3e-05 1.51e-05 2.17e-05 ] [ -1.06e-05 1.13e-05 -2.01e-05 ] [ 1.1e-06 -1.9e-06 -7.4e-06 ] [ 3.2e-05 -1.46e-05 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.586154854592e-14 2.307134333952e-14 3.236396774016e-14 ] [ -2.851874385024e-14 -4.870616927232e-14 -6.72914180736e-15 ] [ 1.329806595264e-14 9.6130597248e-15 -1.393893660096e-14 ] [ -3.68500622784e-14 2.419286697408e-14 3.476723267136e-14 ] [ -1.698307218048e-14 1.810459581504e-14 -3.220375007808e-14 ] [ 1.76239428288e-15 -3.04413557952e-15 -1.185610699392e-14 ] [ 5.12696518656e-14 -2.339177866368e-14 -2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }