{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.985213000000001e-11 3.743003e-11 2.3014772e-10 ] [ 1.7501716e-10 1.8350538e-10 5.387214e-11 ] [ 2.4610974e-10 1.9918271e-10 2.9958672e-10 ] ] "source-value" [ [ 0.5985213 0.3743003 2.3014772 ] [ 1.7501716 1.8350538 0.5387214 ] [ 2.4610974 1.9918271 2.9958672 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.598246901696e-14 1.554111322176e-14 1.3346131251264e-13 ] [ 5.719770536256001e-14 7.658404247424001e-14 -1.073458335936e-13 ] [ -1.0318017437952e-13 -9.212515569600001e-14 -2.627569658112e-14 ] ] "source-value" [ [ 2.87e-05 9.7e-06 8.33e-05 ] [ 3.57e-05 4.78e-05 -6.7e-05 ] [ -6.44e-05 -5.75e-05 -1.64e-05 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -7.115695756307175e-19 "source-value" -4.441268 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.619530736917136e-09 -2.466159175537814e-09 -6.634869734992128e-11 ] [ 1.441665760398394e-10 3.053553173697063e-10 -8.036216720728089e-10 ] [ 2.475364160877297e-09 2.160803858168108e-09 8.699703694227303e-10 ] ] "source-value" [ [ -1.6349825 -1.5392555 -0.0414116 ] [ 0.0899817 0.1905878 -0.5015812 ] [ 1.5450008 1.3486677 0.5429928 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -6.622138999780914e-19 "source-value" -4.1332141 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.351043e-11 3.577073e-11 2.545277e-10 ] [ 1.909392e-10 2.001264e-10 4.651248e-11 ] [ 2.265294e-10 1.84221e-10 2.825664e-10 ] ] "source-value" [ [ 0.6351043 0.3577073 2.545277 ] [ 1.909392 2.001264 0.4651248 ] [ 2.265294 1.84221 2.825664 ] ] } "instance-id" 1 }