{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6573308 -30.0182802 -5.8255803 ] [ -29.7312178 5.2328117 -25.3996153 ] [ -12.4430745 47.8175176 27.64674 ] [ 33.585906 -32.1961633 22.1248269 ] [ 16.2457171 9.1641143 -18.5463714 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.226839638549176e-08 -4.809458673306355e-08 -9.333608559253052e-09 ] [ -4.763466206707281e-08 8.383888566788703e-09 -4.069466981097398e-08 ] [ -1.993600305477265e-08 7.661210876341254e-08 4.42949604693362e-08 ] [ 5.381055338158645e-08 -5.158394011871898e-08 3.544788039842694e-08 ] [ 2.602850812575078e-08 1.468252968179896e-08 -2.971456265775377e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 19.925457 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.192410136415571e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2242986 -0.01846 1.3953942 ] [ 0.0112979 2.0829656 1.1535081 ] [ 0.784454 2.6822723 3.2554894 ] [ 1.9210293 0.7130964 3.4821737 ] [ 1.8470472 1.5664295 -0.2492173 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2242986e-10 -1.846e-12 1.3953942e-10 ] [ 1.12979e-12 2.0829656e-10 1.1535081e-10 ] [ 7.84454e-11 2.6822723e-10 3.2554894e-10 ] [ 1.9210293e-10 7.130964e-11 3.4821737e-10 ] [ 1.8470472e-10 1.5664295e-10 -2.492173e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.68e-05 -5.4e-06 1.77e-05 ] [ -3.28e-05 5.51e-05 4.3e-06 ] [ -1.01e-05 -2.96e-05 -1.43e-05 ] [ 1.36e-05 -3e-06 5.7e-06 ] [ 1.26e-05 -1.7e-05 -1.34e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.691656722944e-14 -8.65175375232e-15 2.835852618816e-14 ] [ -5.255139316223999e-14 8.827993180608e-14 6.889359469440001e-15 ] [ -1.618198387008e-14 -4.742442797568e-14 -2.291112567744e-14 ] [ 2.178960204288e-14 -4.8065298624e-15 9.13240673856e-15 ] [ 2.018742542208e-14 -2.72370025536e-14 -2.146916671872e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.04812 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.25075694301929e-18 } }