{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9063182 -20.4322445 6.322661 ] [ -9.1121599 14.1523464 -1.8567468 ] [ -0.3285015 0.9556974 0.3879856 ] [ 7.4727139 12.6135774 0.3105685 ] [ 14.4615247 5.2014026 -4.6558402 ] [ -7.5872591 -12.4907793 -0.5086281 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.86078831424554e-09 -3.273606444836938e-08 1.013001963544395e-08 ] [ -1.459928955677127e-08 2.267455853154305e-08 -2.974836313705214e-09 ] [ -5.263174231977312e-10 1.531196030839346e-09 6.216214575270605e-10 ] [ 1.197260750450719e-08 2.020917881493125e-08 4.975855898569249e-10 ] [ 2.316991677546174e-08 8.333565641088333e-09 -7.459478318620796e-09 ] [ -1.215612914597205e-08 -2.001243457003259e-08 -8.149120505019245e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -2.6180128 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.194518901115146e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7531882 0.8985532 1.3673962 ] [ 0.4082352 2.9613321 0.6742283 ] [ -0.7823717 4.3287133 1.9322821 ] [ 1.9546911 -0.1778691 2.8663368 ] [ 1.4324192 3.6870656 -1.1390009 ] [ 3.4890873 -0.0350779 4.4351958 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.531882e-11 8.985532000000001e-11 1.3673962e-10 ] [ 4.082352e-11 2.9613321e-10 6.742283e-11 ] [ -7.823717e-11 4.328713300000001e-10 1.9322821e-10 ] [ 1.9546911e-10 -1.778691e-11 2.8663368e-10 ] [ 1.4324192e-10 3.6870656e-10 -1.1390009e-10 ] [ 3.4890873e-10 -3.50779e-12 4.4351958e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1923032 -0.3422652 0.2804485 ] [ -0.1780042 0.5318751 -0.0764479 ] [ 0.0947221 -0.1378215 -0.1714554 ] [ -0.116793 0.0490238 -0.1488397 ] [ -0.0649895 -0.0112024 0.0199618 ] [ 0.0727614 -0.0896099 0.0963328 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.081036911450266e-10 -5.483693015534362e-10 4.493280300384288e-10 ] [ -2.851941676442073e-10 8.521578504056621e-10 -1.224830380892563e-10 ] [ 1.517615340930797e-10 -2.208143851435872e-10 -2.747018333899123e-10 ] [ -1.871230140730944e-10 7.854478622277503e-11 -2.384674875868857e-10 ] [ -1.041246574974816e-10 -1.794822337684992e-11 3.198232926908544e-11 ] [ 1.165766139766771e-10 -1.435708867722259e-10 1.543421599762022e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.931908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.071920065993649e-18 } }