{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.3941721 -40.7834876 -8.4015401 ] [ -13.3981195 7.293788 21.067116 ] [ -11.4702912 8.2234128 -15.9922856 ] [ -3.2089035 8.1005888 0.0015796 ] [ 14.6454831 8.1748677 -20.8431196 ] [ 23.8260031 8.9908303 24.1682496 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.665329953119164e-08 -6.53423503474067e-08 -1.34607511269337e-08 ] [ -2.146615382558459e-08 1.168593661067159e-08 3.375324072288162e-08 ] [ -1.837743239440798e-08 1.317535973134747e-08 -2.56224661014765e-08 ] [ -5.141230166103293e-09 1.297857399007433e-08 2.53079819021568e-12 ] [ 2.346465062314151e-08 1.309758190707307e-08 -3.339435892765825e-08 ] [ 3.817346513392833e-08 1.440489810824025e-08 3.872180447477895e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.87603986950932 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.543621990981652e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6730402 -0.2115903 1.2493114 ] [ 0.2754192 1.1258384 2.6186387 ] [ 0.1869992 1.347694 0.2606582 ] [ 1.1259764 3.0786973 1.5793978 ] [ 2.5235907 1.7412676 0.2100686 ] [ 2.612011 1.5194121 2.5680527 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6730402e-10 -2.115903e-11 1.2493114e-10 ] [ 2.754192e-11 1.1258384e-10 2.6186387e-10 ] [ 1.869992e-11 1.347694e-10 2.606582e-11 ] [ 1.1259764e-10 3.0786973e-10 1.5793978e-10 ] [ 2.5235907e-10 1.7412676e-10 2.100686e-11 ] [ 2.612011e-10 1.5194121e-10 2.5680527e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.8e-06 -6.7e-06 -3.2e-06 ] [ 6.7e-06 9.8e-06 4.1e-06 ] [ 5.4e-06 5.4e-06 -2.9e-06 ] [ -2.58e-05 3.9e-06 3.9e-06 ] [ 1e-05 -7.3e-06 -1.5e-06 ] [ 7.6e-06 -5.2e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.08827115904e-15 -1.073458335936e-14 -5.126965186560001e-15 ] [ 1.073458335936e-14 1.570133088384e-14 6.568924145279999e-15 ] [ 8.65175375232e-15 8.65175375232e-15 -4.646312200320001e-15 ] [ -4.133615681664e-14 6.24848882112e-15 6.24848882112e-15 ] [ 1.6021766208e-14 -1.169588933184e-14 -2.4032649312e-15 ] [ 1.217654231808e-14 -8.33131842816e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }