{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.695832 0.7261586 -6.1336416 ] [ 0.7680399 -5.359271 -0.0230964 ] [ -5.8777079 2.2688088 5.3239835 ] [ -1.2575347 -0.0949985 1.5216852 ] [ 3.5937484 -1.1151783 -1.7129978 ] [ 4.4692863 3.5744803 1.0240671 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.717022405589488e-09 1.163434341498152e-09 -9.827177252850372e-09 ] [ 1.230535581759696e-09 -8.586498771473813e-09 -3.700451240951759e-11 ] [ -9.417126258857207e-09 3.635032446373579e-09 8.529961963501538e-09 ] [ -2.014792712784199e-09 -1.52204376965049e-10 2.438008471743617e-09 ] [ 5.757819714954884e-09 -1.786712615003842e-09 -2.744525049253405e-09 ] [ 7.160586080516313e-09 5.726948815353309e-09 1.640736379268141e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4777608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.518504689640115e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7152083 0.3786325 -0.4016323 ] [ 0.4066659 2.3560738 0.0711369 ] [ -0.2685043 2.2229318 2.8993733 ] [ 2.4923541 -0.3852561 0.7471958 ] [ 3.2062282 1.1364927 1.9711909 ] [ 1.9018704 2.932843 1.7323241 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.152083e-11 3.786325e-11 -4.016323e-11 ] [ 4.066659e-11 2.3560738e-10 7.11369e-12 ] [ -2.685043e-11 2.2229318e-10 2.8993733e-10 ] [ 2.4923541e-10 -3.852561e-11 7.471958e-11 ] [ 3.2062282e-10 1.1364927e-10 1.9711909e-10 ] [ 1.9018704e-10 2.932843e-10 1.7323241e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.67e-05 4.29e-05 1.93e-05 ] [ 2.21e-05 -6.46e-05 2.1e-06 ] [ 9.4e-06 -9.4e-06 1.86e-05 ] [ -4.06e-05 7.38e-05 6.8e-06 ] [ 1.4e-06 -6.96e-05 -9e-07 ] [ -2.91e-05 2.7e-05 -4.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.879988246779999e-14 6.873337759859999e-14 3.09220090362e-14 ] [ 3.54081036114e-14 -1.035006105564e-13 3.364570931399999e-15 ] [ 1.50604603596e-14 -1.50604603596e-14 2.98004853924e-14 ] [ -6.504837134039999e-14 1.182406355892e-13 1.08948011112e-14 ] [ 2.2430472876e-15 -1.115114937264e-13 -1.4419589706e-15 ] [ -4.66233400494e-14 4.325876911799999e-14 -7.353990750059999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.719881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.358384939346056e-18 } }