{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.716359 1.412699 2.394819 ] [ 3.01973 2.981726 2.588794 ] [ 1.169208 3.673412 1.754347 ] [ 3.934247 1.183557 2.830214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.716359e-10 1.412699e-10 2.394819e-10 ] [ 3.01973e-10 2.981726e-10 2.588794e-10 ] [ 1.169208e-10 3.673412e-10 1.754347e-10 ] [ 3.934247e-10 1.183557e-10 2.830214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.6647107 -20.1559894 -0.8512495 ] [ 12.3982297 17.3102835 3.5809113 ] [ -8.9401691 11.9765617 -5.8366635 ] [ 15.2066501 -9.1308558 3.1070017 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.990416336390978e-08 -3.229345525183168e-08 -1.363852058604183e-09 ] [ 1.986415392830483e-08 2.773413175161574e-08 5.737252413286564e-09 ] [ -1.432373003602881e-08 1.918856731139932e-08 -9.351365880220659e-09 ] [ 2.436373947163376e-08 -1.462924381118338e-08 4.977965525538277e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.60909026 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.758701825689847e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.601367 1.2793579 2.2339768 ] [ 3.3183561 3.3463618 2.5502954 ] [ 1.0385467 3.5770664 1.8459461 ] [ 3.8812742 1.0486079 2.9379557 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.601367e-10 1.2793579e-10 2.2339768e-10 ] [ 3.3183561e-10 3.3463618e-10 2.5502954e-10 ] [ 1.0385467e-10 3.5770664e-10 1.8459461e-10 ] [ 3.8812742e-10 1.0486079e-10 2.9379557e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.78e-05 -1.54e-05 -4.9e-05 ] [ -7.34e-05 -2.18e-05 -7.56e-05 ] [ 5.31e-05 2.73e-05 6.9e-05 ] [ 2.5e-06 9.8e-06 5.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.851874408519999e-14 -2.46735201636e-14 -7.850665506599998e-14 ] [ -1.175997649356e-13 -3.492745062119999e-14 -1.211245535304e-13 ] [ 8.507557926539999e-14 4.37394221082e-14 1.10550187746e-13 ] [ 4.005441585e-15 1.57013310132e-14 8.908102085039999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.092646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937455486443356e-18 } }