{ "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" [ [ 3.089476 2.842372 2.086496 ] [ 5.601196 2.528242 2.896237 ] [ 3.884312 0.6907176 1.701618 ] [ 4.215674 4.038258 3.881982 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.089476e-10 2.842372e-10 2.086496e-10 ] [ 5.601196e-10 2.528242e-10 2.896237e-10 ] [ 3.884312e-10 6.907176000000001e-11 1.701618e-10 ] [ 4.215674e-10 4.038258e-10 3.881982e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4859344 0.2011287 0.4616693 ] [ -0.8739062 -1.1062078 -0.8109295 ] [ 0.8406582 0.9550312 0.6050452 ] [ -0.4526864 -0.0499521 -0.255785 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.785527413368096e-10 3.222437035667958e-10 7.396757650951361e-10 ] [ -1.400152093947731e-09 -1.772340289508545e-09 -1.299252296721303e-09 ] [ 1.346882925220499e-09 1.53012867338098e-09 9.693892819538566e-10 ] [ -7.252835726095776e-10 -8.003208743923138e-11 -4.098127503276899e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0322872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.447131950341728e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6634176 2.8701683 2.2111574 ] [ 5.7319167 2.1796343 3.0719965 ] [ 4.1353419 1.1527882 1.7630786 ] [ 4.2599819 3.8969988 3.5201005 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6634176e-10 2.8701683e-10 2.2111574e-10 ] [ 5.731916700000001e-10 2.1796343e-10 3.0719965e-10 ] [ 4.1353419e-10 1.1527882e-10 1.7630786e-10 ] [ 4.2599819e-10 3.8969988e-10 3.5201005e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.4e-06 -3e-06 4.9e-06 ] [ -5.5e-06 -1.4e-06 2.2e-06 ] [ 1e-06 -3.1e-06 -6.9e-06 ] [ 1e-06 7.6e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.4474005556e-15 -4.806529901999999e-15 7.850665506599998e-15 ] [ -8.811971486999999e-15 -2.2430472876e-15 3.5247885948e-15 ] [ 1.602176634e-15 -4.9667475654e-15 -1.10550187746e-14 ] [ 1.602176634e-15 1.21765424184e-14 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -9.6673908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.548886765150656e-18 } }