{ "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" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4626914 -4.0299123 -1.6507769 ] [ -4.6115877 -3.0577301 3.7478194 ] [ -2.9819771 1.9792496 -0.9000225 ] [ 4.0232681 0.7923866 -8.3406682 ] [ 1.0973615 -8.1347663 8.3622688 ] [ -2.1929283 9.5657295 -2.8958334 ] [ 5.1285549 2.8850431 1.6772128 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.413133437252211e-10 -6.456631270934356e-09 -2.6448361553367e-09 ] [ -7.388577997708845e-09 -4.899023678936446e-09 6.004668621660683e-09 ] [ -4.777653993380983e-09 3.171107435847752e-09 -1.441995007693968e-09 ] [ 6.445986089030437e-09 1.269543285155201e-09 -1.336322359189002e-08 ] [ 1.758166939866019e-09 -1.303333238153172e-08 1.339783156820527e-08 ] [ -3.513458453350689e-09 1.532598816579687e-08 -4.639636571211774e-09 ] [ 8.216850759269283e-09 4.622348604820356e-09 2.687191136266506e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.263672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.804639194275958e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1754713 1.2802122 1.5209681 ] [ 2.1122767 1.9096621 3.9623855 ] [ 1.2489257 3.519897 2.2032774 ] [ 4.4595132 2.175071 1.4945565 ] [ 4.5909107 1.7532858 3.9266156 ] [ 3.515681 4.3814793 2.0642283 ] [ 4.6027294 4.1795095 4.2360696 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1754713e-10 1.2802122e-10 1.5209681e-10 ] [ 2.1122767e-10 1.9096621e-10 3.9623855e-10 ] [ 1.2489257e-10 3.519897e-10 2.2032774e-10 ] [ 4.4595132e-10 2.175071e-10 1.4945565e-10 ] [ 4.5909107e-10 1.7532858e-10 3.9266156e-10 ] [ 3.515681e-10 4.3814793e-10 2.0642283e-10 ] [ 4.602729400000001e-10 4.1795095e-10 4.236069600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.27e-05 3.1e-06 -4.2e-06 ] [ 3.23e-05 1.62e-05 -2.2e-05 ] [ -2.4e-06 -5.1e-06 5.11e-05 ] [ 4.6e-06 -1.65e-05 -7.4e-06 ] [ -3.34e-05 -2.68e-05 -1e-06 ] [ 2.98e-05 2.4e-06 3e-07 ] [ -4.36e-05 2.68e-05 -1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.034764308416e-14 4.96674752448e-15 -6.72914180736e-15 ] [ 5.175030485184e-14 2.595526125696e-14 -3.52478856576e-14 ] [ -3.84522388992e-15 -8.17110076608e-15 8.187122532288001e-14 ] [ 7.370012455680001e-15 -2.64359142432e-14 -1.185610699392e-14 ] [ -5.351269913472e-14 -4.293833343744e-14 -1.6021766208e-15 ] [ 4.774486329984001e-14 3.84522388992e-15 4.8065298624e-16 ] [ -6.985490066688e-14 4.293833343744e-14 -2.675634956736e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.446583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.955468401624673e-18 } }