{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3283576 -1.8908798 -0.9209483 ] [ -1.7302752 1.7028732 -1.1166351 ] [ -0.0783505 -0.5559761 -1.1856691 ] [ 0.9841021 -0.5295037 -0.8057791 ] [ 2.1555503 -3.6970039 1.6802719 ] [ 0.347968 0.3760837 0.0291173 ] [ 1.6493629 4.5944067 2.3196424 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.332616776316318e-09 -3.029523433262593e-09 -1.475521847382022e-09 ] [ -2.772206495829676e-09 2.728303651704808e-09 -1.789046665924253e-09 ] [ -1.25531340362217e-10 -8.907719164824472e-10 -1.899651327675809e-09 ] [ 1.576705390090331e-09 -8.483584557565457e-10 -1.291000446185549e-09 ] [ 3.45357232407169e-09 -5.923253264386872e-09 2.692092376946784e-09 ] [ 5.57506198979712e-10 6.025525165682658e-10 4.665105770516819e-11 ] [ 2.642570699366479e-09 7.361051061833047e-09 3.716476852515681e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.941906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.07352193926244e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9625701 2.0877342 3.7951974 ] [ 2.1155497 4.8406261 2.8959288 ] [ 2.7445117 3.1359758 1.4815133 ] [ 4.860721 2.2329734 2.7055361 ] [ 4.1371777 1.6201631 4.8904561 ] [ 4.7310671 4.5655539 2.5093185 ] [ 3.4693797 3.9420644 4.5307137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9625701e-10 2.0877342e-10 3.7951974e-10 ] [ 2.1155497e-10 4.8406261e-10 2.8959288e-10 ] [ 2.7445117e-10 3.1359758e-10 1.4815133e-10 ] [ 4.860721e-10 2.2329734e-10 2.7055361e-10 ] [ 4.1371777e-10 1.6201631e-10 4.8904561e-10 ] [ 4.7310671e-10 4.565553900000001e-10 2.5093185e-10 ] [ 3.4693797e-10 3.9420644e-10 4.5307137e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.551487 -0.3966652 0.2991677 ] [ -0.8079892 0.5573837 -0.6396104 ] [ -0.2233777 -0.0777495 -0.651434 ] [ 0.6431073 -0.3203416 -0.2576101 ] [ 0.2809564 -0.9163288 0.0658716 ] [ 0.2907648 0.0512431 0.138126 ] [ 0.3680254 1.1024583 1.0454893 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.835795853547579e-10 -6.355277149609367e-10 4.793194985875217e-10 ] [ -1.294541416764353e-09 8.930271403124658e-10 -1.024768837743394e-09 ] [ -3.578905314966618e-10 -1.24568432205183e-10 -1.043712333393156e-09 ] [ 1.030371489214828e-09 -5.132438264181743e-10 -4.127368829024034e-10 ] [ 4.501417792527575e-10 -1.468120592421259e-09 1.055379383641944e-10 ] [ 4.658565685496831e-10 8.21004974737254e-11 2.21302249747884e-10 ] [ 5.896416965985036e-10 1.766332928219362e-09 1.675058527557016e-09 ] ] } "relaxed-potential-energy" { "source-value" -14.057262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.252221671441611e-18 } }