{ "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" [ [ 0.1837152 1.359189 0.2246076 ] [ 1.439885 0.3143995 0.1278355 ] [ 1.736921 1.45075 1.267781 ] [ 2.492617 0.9019618 2.872525 ] [ 2.597932 2.758406 2.155931 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.837152e-11 1.359189e-10 2.246076e-11 ] [ 1.439885e-10 3.143995e-11 1.278355e-11 ] [ 1.736921e-10 1.45075e-10 1.267781e-10 ] [ 2.492617e-10 9.019618e-11 2.872525e-10 ] [ 2.597932e-10 2.758406e-10 2.155931e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -120.1538422 38.646783 -39.7527522 ] [ 43.4339219 -93.0515812 -54.481863 ] [ 36.063798 24.587402 42.375404 ] [ 8.8309361 -48.7011455 40.9505956 ] [ 31.8251862 78.5185417 10.9086155 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.925076784581631e-07 6.191897270186842e-08 -6.369093071203209e-08 ] [ 6.958881479116087e-08 -1.490850691553937e-07 -8.728956787538912e-08 ] [ 5.778057448889593e-08 3.939336097516486e-08 6.789288214511013e-08 ] [ 1.414871947576709e-08 -7.802783736913424e-08 6.561008741870321e-08 ] [ 5.098956970233925e-08 1.258005728474946e-07 1.747752886339022e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 74.341533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.191082671083399e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.6098682 1.7568874 0.945294 ] [ 2.5789398 0.0852304 -0.4566018 ] [ 1.6902131 1.3569455 1.3297415 ] [ 1.9554404 0.1638664 3.3556598 ] [ 2.8363451 3.4217765 1.4745866 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.098682e-11 1.7568874e-10 9.45294e-11 ] [ 2.5789398e-10 8.52304e-12 -4.566018e-11 ] [ 1.6902131e-10 1.3569455e-10 1.3297415e-10 ] [ 1.9554404e-10 1.638664e-11 3.3556598e-10 ] [ 2.8363451e-10 3.4217765e-10 1.4745866e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.88e-05 4.4e-06 1.46e-05 ] [ 4.3e-06 1.1e-06 4e-07 ] [ -9.1e-06 -2.05e-05 -1.21e-05 ] [ -5.4e-06 1.94e-05 -1.1e-05 ] [ -8.6e-06 -4.5e-06 8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.012092071919999e-14 7.0495771896e-15 2.33917788564e-14 ] [ 6.8893595262e-15 1.7623942974e-15 6.408706536e-16 ] [ -1.45798073694e-14 -3.2844620997e-14 -1.93863372714e-14 ] [ -8.6517538236e-15 3.10822266996e-14 -1.7623942974e-14 ] [ -1.37787190524e-14 -7.209794853e-15 1.2817413072e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.595203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.33840932150867e-18 } }