{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0013264 -1.6661286 -1.6025719 ] [ -4.9268227 -9.1234659 5.9502917 ] [ -11.569822 0.2674282 -5.052542 ] [ 1.5119908 8.3813759 9.2929397 ] [ 3.6327965 -0.702896 0.4600087 ] [ 6.5771473 7.9528562 -1.5860335 ] [ 4.7733838 -5.1091697 -7.4620926 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.12512706982912e-12 -2.669432290166235e-09 -2.567603231331036e-09 ] [ -7.893640144766732e-09 -1.461740376564603e-08 9.533418248680288e-09 ] [ -1.85368983152175e-08 4.284672097826266e-10 -8.095064668010073e-09 ] [ 2.422476310624688e-09 1.342844451711656e-08 1.488893072584417e-08 ] [ 5.820381620424067e-09 -1.126163538053837e-09 7.37015184504601e-10 ] [ 1.053775163561784e-08 1.274188027222433e-08 -2.541105793505597e-09 ] [ 7.647803926465464e-09 -8.18579224503975e-09 -1.195559030596469e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6129239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.540160193010956e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.991122 1.2024835 2.3457775 ] [ 1.5084031 2.7787758 3.3751979 ] [ 1.3239688 3.9399913 1.2870361 ] [ 3.3765163 4.174272 4.0417516 ] [ 4.9329039 2.6530316 3.0385675 ] [ 3.2656542 5.3906033 1.9799246 ] [ 3.7810227 3.1254071 0.6926501 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.991122e-10 1.2024835e-10 2.3457775e-10 ] [ 1.5084031e-10 2.7787758e-10 3.3751979e-10 ] [ 1.3239688e-10 3.9399913e-10 1.2870361e-10 ] [ 3.3765163e-10 4.174272e-10 4.0417516e-10 ] [ 4.9329039e-10 2.6530316e-10 3.0385675e-10 ] [ 3.2656542e-10 5.3906033e-10 1.9799246e-10 ] [ 3.7810227e-10 3.1254071e-10 6.926501000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.97e-05 4.8e-05 8.8e-06 ] [ -2e-07 -1.38e-05 5.9e-06 ] [ 2.1e-06 9e-07 1.09e-05 ] [ 6.9e-06 -1.67e-05 -1.98e-05 ] [ -4.04e-05 -6e-07 3.46e-05 ] [ 1.05e-05 4.3e-06 1.69e-05 ] [ -8.7e-06 -2.21e-05 -5.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.758464563776e-14 7.69044777984e-14 1.409915426304e-14 ] [ -3.2043532416e-16 -2.211003736704e-14 9.45284206272e-15 ] [ 3.36457090368e-15 1.44195895872e-15 1.746372516672e-14 ] [ 1.105501868352e-14 -2.675634956736e-14 -3.172309709184e-14 ] [ -6.472793548032e-14 -9.6130597248e-16 5.543531107968001e-14 ] [ 1.68228545184e-14 6.889359469440001e-15 2.707678489152e-14 ] [ -1.393893660096e-14 -3.540810331968e-14 -9.212515569600001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.968507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.039089844688114e-18 } }