{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.647614 -2.9117507 -1.2400201 ] [ -0.1306044 0.2289282 -0.2441388 ] [ 4.1133642 -0.1633281 -1.3991065 ] [ -1.2313192 2.7709333 -0.673805 ] [ -0.1038266 0.0752173 3.5570704 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.241945251702771e-09 -4.665138897138034e-09 -1.986731213542078e-09 ] [ -2.092513162536115e-10 3.667834098818266e-10 -3.911534775901671e-10 ] [ 6.590335954075696e-09 -2.616804633396845e-10 -2.241615724309315e-09 ] [ -1.972790834982159e-09 4.439524551056192e-09 -1.079554617978144e-09 ] [ -1.663485511371533e-10 1.205113995396999e-10 5.699055033419704e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.5045949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.362586311815492e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6330807 1.9456731 1.5348625 ] [ 4.5696535 1.6465722 2.9640268 ] [ 5.7083629 3.227635 1.5197547 ] [ 3.5076855 4.1813492 1.8799975 ] [ 3.7746094 3.5685995 4.2114316 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6330807e-10 1.9456731e-10 1.5348625e-10 ] [ 4.5696535e-10 1.6465722e-10 2.9640268e-10 ] [ 5.7083629e-10 3.227635e-10 1.5197547e-10 ] [ 3.5076855e-10 4.1813492e-10 1.8799975e-10 ] [ 3.7746094e-10 3.5685995e-10 4.2114316e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-06 7.1e-06 -4.8e-06 ] [ 3.34e-05 -3.4e-06 -3.8e-06 ] [ -2.51e-05 -1.76e-05 3.8e-06 ] [ 6.8e-06 1.31e-05 -1.94e-05 ] [ -1.32e-05 7e-07 2.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-15 1.137545400768e-14 -7.69044777984e-15 ] [ 5.351269913472e-14 -5.44740051072e-15 -6.08827115904e-15 ] [ -4.021463318208e-14 -2.819830852608e-14 6.08827115904e-15 ] [ 1.089480102144e-14 2.098851373248e-14 -3.108222644352e-14 ] [ -2.114873139456e-14 1.12152363456e-15 3.877267422336e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.415273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.668710689984948e-18 } }