{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.753194 -4.7131965 -8.7301502 ] [ -4.2742814 -2.5212144 -0.8294015 ] [ 5.8582126 -0.8307898 5.718679 ] [ -6.0033056 5.1584879 0.4234966 ] [ 4.6421188 0.1088285 -2.3018437 ] [ -0.3514517 -3.3778868 4.5220051 ] [ 3.8819013 6.1757711 1.1972148 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.013279729668995e-09 -7.55137330375058e-09 -1.398724266175043e-08 ] [ -6.848153786220806e-09 -4.039430800984329e-09 -1.328847703504551e-09 ] [ 9.385891344724387e-09 -1.331072005325533e-09 9.162333871146485e-09 ] [ -9.618355959081349e-09 8.264808780151729e-09 6.785163570984444e-10 ] [ 7.437494273612119e-09 1.74362479813269e-10 -3.687960191260105e-09 ] [ -5.630877017195777e-10 -5.411971303257031e-09 7.245050910048833e-09 ] [ 6.219491558354224e-09 9.894676153352477e-09 1.918149578438983e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.860095 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.060414372002023e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4863984 2.7724481 0.8756896 ] [ 1.3085619 2.0398122 2.869943 ] [ 3.5808475 3.6112524 4.9696436 ] [ 1.411725 4.243869 3.8861129 ] [ 4.6555265 2.1398325 1.9592077 ] [ 3.4296767 1.4212014 3.9294781 ] [ 3.6010769 4.4397735 2.5152852 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4863984e-10 2.7724481e-10 8.756896e-11 ] [ 1.3085619e-10 2.0398122e-10 2.869943e-10 ] [ 3.5808475e-10 3.6112524e-10 4.969643600000001e-10 ] [ 1.411725e-10 4.243869e-10 3.8861129e-10 ] [ 4.6555265e-10 2.1398325e-10 1.9592077e-10 ] [ 3.4296767e-10 1.4212014e-10 3.9294781e-10 ] [ 3.6010769e-10 4.4397735e-10 2.5152852e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.86e-05 -6.1e-06 -2.61e-05 ] [ 1.16e-05 1.92e-05 -8.2e-06 ] [ 5.4e-06 -3.39e-05 2.89e-05 ] [ 2e-06 -1.33e-05 -8.1e-06 ] [ -9.4e-06 6.4e-06 6.7e-06 ] [ 8.2e-06 2.48e-05 2.6e-05 ] [ 8e-07 2.9e-06 -1.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.98004853924e-14 -9.773277467399999e-15 -4.18168101474e-14 ] [ 1.85852489544e-14 3.076179137279999e-14 -1.31378483988e-14 ] [ 8.6517538236e-15 -5.431378789259999e-14 4.63029047226e-14 ] [ 3.204353268e-15 -2.13089492322e-14 -1.29776307354e-14 ] [ -1.50604603596e-14 1.02539304576e-14 1.07345834478e-14 ] [ 1.31378483988e-14 3.97339805232e-14 4.165659248399999e-14 ] [ 1.2817413072e-15 4.6463122386e-15 -3.076179137279999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.735789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.841586672135423e-18 } }