{ "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" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9262545 -2.636365 -0.4931504 ] [ 1.9446023 0.9055679 -2.6567673 ] [ 4.3576844 -8.9653641 5.9759796 ] [ 2.8550402 6.272559 -11.0974172 ] [ -4.2310724 4.4236022 8.2713552 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.892729853037352e-09 -4.22392240169541e-09 -7.901140479277535e-10 ] [ 3.115596367482658e-09 1.450879729880449e-09 -4.256610490035267e-09 ] [ 6.981780124026309e-09 -1.436409687632244e-08 9.574574880380665e-09 ] [ 4.574278697570687e-09 1.00497474651864e-08 -1.77800225355897e-08 ] [ -6.778925336042302e-09 7.087392082950995e-09 1.32521720329544e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.626030932689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.809542034516621e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5948499 0.6502982 0.1493731 ] [ 0.788419 0.4067873 2.5115938 ] [ 3.0967451 0.3153646 1.9283952 ] [ 2.4919681 2.0645817 0.4279492 ] [ 1.2289839 2.74138 2.3315408 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.948499000000001e-11 6.502982000000001e-11 1.493731e-11 ] [ 7.884190000000001e-11 4.067873000000001e-11 2.5115938e-10 ] [ 3.0967451e-10 3.153646e-11 1.9283952e-10 ] [ 2.4919681e-10 2.0645817e-10 4.279492e-11 ] [ 1.2289839e-10 2.74138e-10 2.3315408e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.6e-06 1.49e-05 -2.5e-06 ] [ 8.3e-06 -2e-07 -2.17e-05 ] [ 1.5e-05 9.3e-06 9.4e-06 ] [ -2.33e-05 -3.05e-05 1.68e-05 ] [ 4.6e-06 6.5e-06 -2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.370012516399999e-15 2.38724318466e-14 -4.005441585e-15 ] [ 1.32980660622e-14 -3.204353268e-16 -3.476723295779999e-14 ] [ 2.403264951e-14 1.49002426962e-14 1.50604603596e-14 ] [ -3.733071557219999e-14 -4.886638733699999e-14 2.691656745119999e-14 ] [ 7.370012516399999e-15 1.0414148121e-14 -3.204353268e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }