{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3829764 3.9500653 1.2341312 ] [ -13.0526326 27.8055043 6.9758084 ] [ -46.0249006 -16.7998051 -14.0260953 ] [ 18.6359575 -22.2381425 -0.9175128 ] [ 1.8407698 -1.9927167 0.8114488 ] [ 41.1878465 10.5302861 3.8531266 ] [ -3.9700169 -1.2551914 2.0690931 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.215772455198149e-09 6.328702274293339e-09 1.977296155639849e-09 ] [ -2.091262279161192e-08 4.454932891901387e-08 1.117647712966026e-08 ] [ -7.374001971596389e-08 -2.691625496521661e-08 -2.247228197077276e-08 ] [ 2.985809541272242e-08 -3.562943200351886e-08 -1.470017557444746e-09 ] [ 2.949238337834692e-09 -3.192684108617727e-09 1.300084296336215e-09 ] [ 6.599020472339911e-08 1.687137819975521e-08 6.173389355502593e-09 ] [ -6.360668261360892e-09 -2.011038315709221e-09 3.315052591078597e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.345956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657604882302548e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2508993 1.6770882 3.240888 ] [ 2.8807067 6.0146654 2.5859312 ] [ 2.5017553 3.6352797 1.400962 ] [ 4.5550604 1.889373 1.9636032 ] [ 5.7876821 2.9945152 4.0239502 ] [ 5.0738868 4.59334 1.9704211 ] [ 3.3233123 3.9012295 4.1422171 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2508993e-10 1.6770882e-10 3.240888e-10 ] [ 2.8807067e-10 6.014665400000001e-10 2.5859312e-10 ] [ 2.5017553e-10 3.6352797e-10 1.400962e-10 ] [ 4.555060400000001e-10 1.889373e-10 1.9636032e-10 ] [ 5.787682099999999e-10 2.9945152e-10 4.0239502e-10 ] [ 5.073886800000001e-10 4.59334e-10 1.9704211e-10 ] [ 3.3233123e-10 3.9012295e-10 4.1422171e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.63e-05 4.1e-05 2.8e-06 ] [ -3.75e-05 -0.0001049 -3.2e-05 ] [ 0.0001126 7.58e-05 0.000123 ] [ -1.8e-05 3.49e-05 -2.1e-05 ] [ 2.4e-05 1.3e-06 1.9e-05 ] [ -8.85e-05 -4.8e-05 4.06e-05 ] [ 3.37e-05 -1e-07 -0.0001323 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.213724512704e-14 6.56892414528e-14 4.48609453824e-15 ] [ -6.008162327999999e-14 -1.6806832752192e-13 -5.12696518656e-14 ] [ 1.8040508750208e-13 1.2144498785664e-13 1.970677243584e-13 ] [ -2.88391791744e-14 5.591596406592e-14 -3.36457090368e-14 ] [ 3.84522388992e-14 2.08282960704e-15 3.04413557952e-14 ] [ -1.417926309408e-13 -7.69044777984e-14 6.504837080448e-14 ] [ 5.399335212096e-14 -1.6021766208e-16 -2.1196796693184e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.768314 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.968321362743333e-18 } }