{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 19.3100836 -35.5880848 -21.9030892 ] [ -56.3090621 25.8285449 -13.7600692 ] [ -38.1756289 24.9723054 15.9033558 ] [ 53.4615724 -22.5601764 6.5940559 ] [ 21.713035 7.347411 13.1657467 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.093816448961349e-08 -5.701839744560784e-08 -3.509261743953698e-08 ] [ -9.021706283579535e-08 4.138189078806307e-08 -2.204606117283016e-08 ] [ -6.116410010791682e-08 4.001004387935759e-08 2.547998485502408e-08 ] [ 8.565488141048655e-08 -3.614538718920391e-08 1.05648421992283e-08 ] [ 3.478811704361213e-08 1.177185012760875e-08 2.109385155811475e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.896239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.707075910524918e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5157851 0.4156283 2.0296128 ] [ 0.213009 2.6952348 -0.2654158 ] [ -0.6045932 1.7067441 1.9781654 ] [ 2.3884061 1.3078377 -0.117038 ] [ 2.8557088 1.402287 3.7558129 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5157851e-10 4.156283e-11 2.0296128e-10 ] [ 2.13009e-11 2.6952348e-10 -2.654158e-11 ] [ -6.045932000000001e-11 1.7067441e-10 1.9781654e-10 ] [ 2.3884061e-10 1.3078377e-10 -1.17038e-11 ] [ 2.8557088e-10 1.402287e-10 3.7558129e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.05e-05 9.6e-06 -8.3e-06 ] [ -0.0 -3.5e-06 4.5e-06 ] [ 2.43e-05 -6.1e-06 -1e-07 ] [ -6.8e-06 -1.5e-06 -4.6e-06 ] [ -6.9e-06 1.6e-06 8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.68228545184e-14 1.538089555968e-14 -1.329806595264e-14 ] [ 0.0 -5.6076181728e-15 7.2097947936e-15 ] [ 3.893289188544e-14 -9.77327738688e-15 -1.6021766208e-16 ] [ -1.089480102144e-14 -2.4032649312e-15 -7.370012455680001e-15 ] [ -1.105501868352e-14 2.56348259328e-15 1.36185012768e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }