{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.2249197e-10 2.494718e-11 4.9969708e-10 ] [ 5.322616e-11 2.9492645e-10 -1.242927e-11 ] [ 2.2875773e-10 7.2761629e-10 3.1490282e-10 ] [ -1.7740248e-10 4.0250503e-10 4.9388159e-10 ] [ 6.673673400000001e-10 -6.553591e-11 1.8921675e-10 ] [ 5.827426400000001e-10 4.4501789e-10 2.92073e-12 ] [ 6.068259600000001e-10 4.2190208e-10 5.7283431e-10 ] ] "source-value" [ [ 2.2249197 0.2494718 4.9969708 ] [ 0.5322616 2.9492645 -0.1242927 ] [ 2.2875773 7.2761629 3.1490282 ] [ -1.7740248 4.0250503 4.9388159 ] [ 6.6736734 -0.6553591 1.8921675 ] [ 5.8274264 4.4501789 0.0292073 ] [ 6.0682596 4.2190208 5.7283431 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 -4.8065298624e-16 4.8065298624e-16 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -6.408706483200001e-16 6.408706483200001e-16 0.0 ] [ 8.010883104e-16 -1.6021766208e-16 -4.8065298624e-16 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-value" [ [ -0.0 -3e-07 3e-07 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ -4e-07 4e-07 -0.0 ] [ 5e-07 -1e-07 -3e-07 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "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" 5.729784781006648e-31 "source-value" 3.5762504e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.316032522637321e-09 -4.218903228195412e-09 2.611132928159213e-09 ] [ -3.066804936745361e-09 -4.780906251703546e-10 -4.588832672089842e-09 ] [ -1.161803956983533e-09 5.862427861919046e-09 6.164214330865921e-10 ] [ -4.510731368355704e-09 8.478798786104641e-11 2.452309159739308e-09 ] [ 2.733987991659819e-09 -4.016554889912517e-09 -7.745280672510259e-10 ] [ 3.455007205000015e-09 1.168212503249071e-09 -4.734169477933513e-09 ] [ 3.866377748279747e-09 1.598120390249121e-09 4.417666696289267e-09 ] ] "source-value" [ [ -0.8214029 -2.6332323 1.629741 ] [ -1.9141491 -0.2984007 -2.8641241 ] [ -0.725141 3.6590397 0.38474 ] [ -2.8153771 0.0529205 1.530611 ] [ 1.7064211 -2.5069364 -0.4834224 ] [ 2.1564459 0.7291409 -2.9548362 ] [ 2.4132032 0.9974683 2.7572907 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.536471657847595e-18 "source-value" 15.831411 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] "source-value" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] } "instance-id" 1 }