{ "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" [ [ 2.966654 1.561504 1.979713 ] [ 1.215751 3.296566 1.975446 ] [ 1.823708 4.192867 4.123573 ] [ 5.205541 2.34853 2.95907 ] [ 3.135824 2.260061 4.318186 ] [ 3.662306 3.63962 2.333021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966654e-10 1.561504e-10 1.979713e-10 ] [ 1.215751e-10 3.296566e-10 1.975446e-10 ] [ 1.823708e-10 4.192867e-10 4.123573e-10 ] [ 5.205541e-10 2.34853e-10 2.95907e-10 ] [ 3.135824e-10 2.260061e-10 4.318186e-10 ] [ 3.662306e-10 3.63962e-10 2.333021e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8721179 -5.0613991 -1.8807192 ] [ -1.1113891 0.6330083 -0.5973204 ] [ -1.0022529 0.5665073 0.4915352 ] [ 5.4145196 -3.4380603 1.9082319 ] [ 0.3213375 -1.2504634 2.8850031 ] [ -1.7500972 8.5504072 -2.8067304 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.999463555473148e-09 -8.10925537336863e-09 -3.013244357355173e-09 ] [ -1.780641647302289e-09 1.014191107388062e-09 -9.570127878915336e-10 ] [ -1.605786177738738e-09 9.076447590504282e-10 7.875262122285167e-10 ] [ 8.675016787455025e-09 -5.50837987894303e-09 3.057324562433425e-09 ] [ 5.148394341279749e-10 -2.003463241152195e-09 4.622284555837565e-09 ] [ -2.803964841068824e-09 1.369926262702536e-08 -4.496877864817473e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.339797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.65661811537033e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9532034 1.5239338 1.9685525 ] [ 1.2072129 3.3017856 1.9710895 ] [ 1.8170409 4.1960852 4.1276528 ] [ 5.2432446 2.325254 2.972795 ] [ 3.1377838 2.2518601 4.334772 ] [ 3.6512984 3.7002293 2.3141471 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9532034e-10 1.5239338e-10 1.9685525e-10 ] [ 1.2072129e-10 3.3017856e-10 1.9710895e-10 ] [ 1.8170409e-10 4.1960852e-10 4.1276528e-10 ] [ 5.2432446e-10 2.325254e-10 2.972795e-10 ] [ 3.1377838e-10 2.2518601e-10 4.334772e-10 ] [ 3.6512984e-10 3.700229300000001e-10 2.3141471e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.8207063 -2.5673211 -0.0200165 ] [ -0.6621978 0.5050894 -0.2869985 ] [ -0.2735813 -0.042669 0.4068805 ] [ 1.9481388 -0.9971111 0.8291738 ] [ 0.0229932 -0.2992603 -0.1074202 ] [ -0.2146465 3.401272 -0.8216191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.314916457236594e-09 -4.113301878395177e-09 -3.206996859446099e-11 ] [ -1.060957842246205e-09 8.092424347610795e-10 -4.598222906930489e-10 ] [ -4.383255663593442e-10 -6.8363274796146e-11 6.518944299302368e-10 ] [ 3.121262465148799e-09 -1.597548105922037e-09 1.328482887884989e-09 ] [ 3.68391677808888e-11 -4.794678601438301e-10 -1.721061344596068e-10 ] [ -3.439016068698809e-10 5.449438524278447e-09 -1.31637892406811e-09 ] ] } "relaxed-potential-energy" { "source-value" -11.528817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.847120121506198e-18 } }